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Sample records for high-flashpoint organic liquid

  1. Occupational exposures to new dry cleaning solvents: High-flashpoint hydrocarbons and butylal.

    PubMed

    Ceballos, Diana M; Whittaker, Stephen G; Lee, Eun Gyung; Roberts, Jennifer; Streicher, Robert; Nourian, Fariba; Gong, Wei; Broadwater, Kendra

    2016-10-01

    The dry cleaning industry is moving away from using perchloroethylene. Occupational exposures to two alternative dry cleaning solvents, butylal and high-flashpoint hydrocarbons, have not been well characterized. We evaluated four dry cleaning shops that used these alternative solvents. The shops were staffed by Korean- and Cantonese-speaking owners, and Korean-, Cantonese-, and Spanish-speaking employees. Because most workers had limited English proficiency we used language services in our evaluations. In two shops we collected personal and area air samples for butylal. We also collected air samples for formaldehyde and butanol, potential hydrolysis products of butylal. Because there are no occupational exposure limits for butylal, we assessed employee health risks using control banding tools. In the remaining two shops we collected personal and area air samples for high-flashpoint hydrocarbon solvents. In all shops the highest personal airborne exposures occurred when workers loaded and unloaded the dry cleaning machines and pressed dry cleaned fabrics. The air concentrations of formaldehyde and butanol in the butylal shops were well below occupational exposure limits. Likewise, the air concentrations of high-flashpoint hydrocarbons were also well below occupational exposure limits. However, we saw potential skin exposures to these chemicals. We provided recommendations on appropriate work practices and the selection and use of personal protective equipment. These recommendations were consistent with those derived using control banding tools for butylal. However, there is insufficient toxicological and health information to determine the safety of butylal in occupational settings. Independent evaluation of the toxicological properties of these alternative dry cleaning solvents, especially butylal, is urgently needed. PMID:27105306

  2. Immobilization of organic liquid wastes

    SciTech Connect

    Greenhalgh, W.O.

    1985-08-07

    This report describes a portland cement immobilization process for the disposal treatment of radioactive organic liquid wastes which would be generated in a a FFTF fuels reprocessing line. An incineration system already on-hand was determined to be too costly to operate for the 100 to 400 gallons per year organic liquid. Organic test liquids were dispersed into an aqueous phosphate liquid using an emulsifier. A total of 109 gallons of potential and radioactive aqueous immiscible organic liquid wastes from Hanford 300 Area operations were solidified with portland cement and disposed of as solid waste during a 3-month test program with in-drum mixers. Waste packing efficiencies varied from 32 to 40% and included pump oils, mineral spirits, and TBP-NPH type solvents.

  3. Organic reactivity in liquid ammonia.

    PubMed

    Ji, Pengju; Atherton, John; Page, Michael I

    2012-08-14

    Liquid ammonia is a useful solvent for many organic reactions including aliphatic and aromatic nucleophilic substitution and metal-ion catalysed reactions. The acidity of acids is modified in liquid ammonia giving rise to differences from conventional solvents. The ionisation constants of phenols and carbon acids are the product of those for ion-pair formation and dissociation to the free ions. There is a linear relationship between the pK(a) of phenols and carbon acids in liquid ammonia and those in water of slope 1.68 and 0.7, respectively. Aminium ions exist in their unprotonated free base form in liquid ammonia. The rates of solvolysis and aminolysis by neutral amines of substituted benzyl chlorides in liquid ammonia show little or no dependence upon ring substituents, in stark contrast with the hydrolysis rates of substituted benzyl halides in water which vary 10(7) fold. However, the rates of the reaction of phenoxide ions and amine anions with 4-substituted benzyl chlorides gives a Hammett ρ = 1.1 and 0.93, respectively. The second order rate constants for the substitution of benzyl chlorides by neutral and anionic amines show a single Brønsted β(nuc) = 0.21 whereas those for substituted phenoxide ions generate a Brønsted β(nuc) = 0.40. The rates of aromatic nucleophilic substitution reactions in liquid ammonia are much faster than those in protic solvents indicating that liquid ammonia behaves like a typical dipolar aprotic solvent in its solvent effects on organic reactions. Nitrofluorobenzenes (NFB) readily undergo solvolysis in liquid ammonia but oxygen nucleophiles, such as alkoxide and phenoxide ions, displace the fluorine of 4-NFB in liquid ammonia to give the corresponding substitution product with little or no competing solvolysis product. The Brønsted β(nuc) for the reaction of 4-NFB with para-substituted phenoxides is 0.91, indicative that the decomposition of the Meisenheimer σ-intermediate is rate limiting. The aminolysis of 4-NFB occurs

  4. REMOVAL OF URANIUM FROM ORGANIC LIQUIDS

    DOEpatents

    Vavalides, S.P.

    1959-08-25

    A process is described for recovering small quantities of uranium from organic liquids such as hydrocarbon oils. halogen-substituted hydrocarbons, and alcohols. The organic liquid is contacted with a comminuted alkaline earth hydroxide, calcium hydroxide particularly, and the resulting uranium-bearing solid is separated from the liquid by filtration. Uranium may then be recovered from the solid by means of dissolution in nitric acid and conventional extraction with an organic solvent such as tributyl phosphate.

  5. Ionic Liquid Extractions of Soil Organic Matter

    NASA Astrophysics Data System (ADS)

    Patti, Antonio; Macfarlane, Douglas; Clarke, Michael

    2010-05-01

    A large range of ionic liquids with the ability to dissolve different classes of natural biopolymers (e.g. cellulose, lignin, protein) have been reported in the literature. These have the potential to isolate different fractions of soil organic matter, thus yielding novel information that is not available through other extraction procedures. The ionic liquids dimethylammonium dimethylcarbamate (DIMCARB), alkylbenzenesulfonate and 1-butyl-3methylimidazolium chloride (Bmim Cl) can solubilise selected components of soil organic matter. Soil extractions with these materials showed that the organic matter recovered showed chemical properties that were consistent with humic substances. These extracts had a slightly different organic composition than the humic acids extracted using the traditional International Humic Substances Society (IHSS) method. The ionic liquids also solubilised some inorganic matter from the soil. Humic acids recovered with alkali were also partially soluble in the ionic liquids. DIMCARB appeared to chemically interfere with organic extract, increasing the level of nitrogen in the sample. It was concluded that the ionic liquid Bmim Cl may function as a useful solvent for SOM, and may be used to recover organic matter of a different character to that obtained with alkali

  6. A mechanism for supercooling in organic liquids

    SciTech Connect

    Thoma, P.E.

    1996-12-31

    In this investigation, a mechanism for supercooling inorganic liquids is formulated. By comparing the melting temperature and spontaneous freezing temperature of the chemicals evaluated with their molecular characteristics, the factors promoting supercooling are developed. The results obtained indicate that the following molecular characteristics promote supercooling in organic liquids: an unequal sharing of electrons between the atoms of a molecule; a three-dimensional chemical structure; a permanent, three-dimensional, and partially charged pocket within the chemical structure; a partially charged projection having a charge opposite that of the pocket and located on the side of the molecule opposite that of the pocket.

  7. Solidification of oils and organic liquids

    SciTech Connect

    Clark, D.E.; Colombo, P.; Neilson, R.M. Jr.

    1982-07-01

    The suitability of selected solidification media for application in the disposal of low-level oil and other organic liquid wastes has been investigated. In the past, these low-level wastes (LLWs) have commonly been immobilized by sorption onto solid absorbents such as vermiculite or diatomaceous earth. Evolving regulations regarding the disposal of these materials encourage solidification. Solidification media which were studied include Portland type I cement; vermiculite plus Portland type I cement; Nuclear Technology Corporation's Nutek 380-cement process; emulsifier, Portland type I cement-sodium silicate; Delaware Custom Materiel's cement process; and the US Gypsum Company's Envirostone process. Waste forms have been evaluated as to their ability to reliably produce free standing monolithic solids which are homogeneous (macroscopically), contain < 1% free standing liquids by volume and pass a water immersion test. Solidified waste form specimens were also subjected to vibratory shock testing and flame testing. Simulated oil wastes can be solidified to acceptable solid specimens having volumetric waste loadings of less than 40 volume-%. However, simulated organic liquid wastes could not be solidified into acceptable waste forms above a volumetric loading factor of about 10 volume-% using the solidification agents studied.

  8. Method and apparatus for destroying organic contaminants in aqueous liquids

    DOEpatents

    Donaldson, T.L.; Wilson, J.H.

    1993-09-21

    A method and apparatus for destroying organic contaminants, such as trichloroethylene, in aqueous liquids, such as groundwater, utilizing steam stripping integrated with biodegradation. The contaminated aqueous liquid is fed into a steam stripper causing the volatilization of essentially all of the organic contaminants and a portion of the aqueous liquid. The majority of the aqueous liquid is discharged from the steam stripper. The volatilized vapors are then condensed to the liquid phase and introduced into a bioreactor. The bioreactor contains methanotrophic microorganisms which convert the organic contaminants into mainly carbon dioxide. The effluent from the bioreactor is then recycled back to the steam stripper for further processing. 2 figures.

  9. Method and apparatus for destroying organic contaminants in aqueous liquids

    DOEpatents

    Donaldson, Terrence L.; Wilson, James H.

    1993-01-01

    A method and apparatus for destroying organic contaminants, such as trichloroethylene, in aqueous liquids, such as groundwater, utilizing steam stripping integrated with biodegradation. The contaminated aqueous liquid is fed into a steam stripper causing the volatilization of essentially all of the organic contaminants and a portion of the aqueous liquid. The majority of the aqueous liquid is discharged from the steam stripper. The volatilized vapors are then condensed to the liquid phase and introduced into a bioreactor. The bioreactor contains methanotrophic microorganisms which convert the organic contaminants into mainly carbon dioxide. The effluent from the bioreactor is then recycled back to the steam stripper for further processing.

  10. Visualization of residual organic liquid trapped in aquifers

    SciTech Connect

    Conrad, S.H.; Wilson, J.L.; Mason, W.R.; Peplinski, W.J. )

    1992-02-01

    Organic liquids that are essentially immiscible with water migrate through the subsurface under the influence of capillary, viscous, and buoyancy forces. These liquids originate from the improper disposal of hazardous wastes, and the spills and leaks of petroleum hydrocarbons and solvents. The flow visualization experiments described in this study examined the migration of organic liquids through the saturated zone of aquifers, with a primary focus on the behavior of the residual organic liquid saturation, referring to that portion of the organic liquid that is trapped by capillary forces. Etched glass micromodels were used to visually observe dynamic multiphase displacement processes in pore networks. The resulting fluid distributions were photographed. Pore and blob casts were produced by a technique in which an organic liquid was solidified in place within a sand column at the conclusion of a displacement. The columns were sectioned and examined under optical and scanning electron microscopes. Photomicrographs of these sections show the morphology of the organic phase and its location within the sand matrix. The photographs from both experimental techniques reveal that in the saturated zone large amounts of residual organic liquid are trapped as isolated blobs of microscopic size. The size, shape, and spatial distribution of these blobs of residual organic liquid affect the dissolution of organic liquid into the water phase and the biotransformation of organic components. These processes are of concern for the prediction of pollution migration and the design of aquifer remediation schemes.

  11. Investigation of the organic matter in inactive nuclear tank liquids

    SciTech Connect

    Schenley, R.L.; Griest, W.H.

    1990-08-01

    Environmental Protection Agency (EPA) methodology for regulatory organics fails to account for the organic matter that is suggested by total organic carbon (TOC) analysis in the Oak Ridge National Laboratory (ORNL) inactive nuclear waste-tank liquids and sludges. Identification and measurement of the total organics are needed to select appropriate waste treatment technologies. An initial investigation was made of the nature of the organics in several waste-tank liquids. This report details the analysis of ORNL wastes.

  12. Method for removing organic liquids from aqueous solutions and mixtures

    DOEpatents

    Hrubesh, Lawrence W.; Coronado, Paul R.; Dow, Jerome P.

    2004-03-23

    A method for removing organic liquids from aqueous solutions and mixtures. The method employs any porous material preferably in granular form and having small pores and a large specific surface area, that is hydrophobic so that liquid water does not readily wet its surface. In this method, organics, especially organic solvents that mix with and are more volatile than water, are separated from aqueous solution by preferentially evaporating across the liquid/solid boundary formed at the surfaces of the hydrophobic porous materials. Also, organic solvents that are immiscible with water, preferentially wet the surfaces of the hydrophobic material and are drawn within the porous materials by capillary action.

  13. Liquid crystal-templated conducting organic polymers

    DOEpatents

    Stupp, Samuel I.; Hulvat, James F.

    2004-01-20

    A method of preparing a conductive polymeric film, includes providing a liquid crystal phase comprising a plurality of hydrophobic cores, the phase on a substrate, introducing a hydrophobic component to the phase, the component a conductive polymer precursor, and applying an electric potential across the liquid crystal phase, the potential sufficient to polymerize the said precursor.

  14. Process for encapsulating radioactive organic liquids in a resin

    SciTech Connect

    Drake, S.S.; Filter, H.E.

    1983-05-03

    Radioactive organic liquids are converted to a form suitable for burial by the process wherein the liquid is contacted with insoluble, swellable polymer particles to form swollen gelled particles which are dispersed in an unsaturated polyester, vinyl ester resin or mixture thereof which is then cured to a solid state with the gelled particles encased therein.

  15. Ionization and Excitation in Non-Polar Organic Liquids.

    ERIC Educational Resources Information Center

    Lipsky, Sanford

    1981-01-01

    Reviews recent advances in radiation chemistry concerning the effect of high-energy radiation on organic liquids. Discusses the general nature of excited and ionized states, pathways for decay, the effect of environmental perturbation, the behavior of an electron in a nonpolar liquid, and comparison of photochemical and radiation chemical effects.…

  16. Process for recovering organic components from liquid streams

    DOEpatents

    Blume, Ingo; Baker, Richard W.

    1991-01-01

    A separation process for recovering organic components from liquid streams. The process is a combination of pervaporation and decantation. In cases where the liquid stream contains the organic to be separated in dissolved form, the pervaporation step is used to concentrate the organic to a point above the solubility limit, so that a two-phase permeate is formed and then decanted. In cases where the liquid stream is a two-phase mixture, the decantation step is performed first, to remove the organic product phase, and the residue from the decanter is then treated by pervaporation. The condensed permeate from the pervaporation unit is sufficiently concentrated in the organic component to be fed back to the decanter. The process can be tailored to produce only two streams: an essentially pure organic product stream suitable for reuse, and a residue stream for discharge or reuse.

  17. A Guided Inquiry Liquid/Liquid Extractions Laboratory for Introductory Organic Chemistry

    ERIC Educational Resources Information Center

    Raydo, Margaret L.; Church, Megan S.; Taylor, Zane W.; Taylor, Christopher E.; Danowitz, Amy M.

    2015-01-01

    A guided inquiry laboratory experiment for teaching liquid/liquid extractions to first semester undergraduate organic chemistry students is described. This laboratory is particularly useful for introductory students as the analytes that are separated are highly colored dye molecules. This allows students to track into which phase each analyte…

  18. Hierarchical organization in liquid crystal-in-liquid crystal emulsions.

    PubMed

    Mushenheim, Peter C; Abbott, Nicholas L

    2014-11-21

    We report the formation and characterization of hierarchical ordering in systems comprised of micrometer-sized droplets of thermotropic nematic liquid crystals (LCs) dispersed in continuous nematic phases of a lyotropic chromonic LC (disodium cromoglycate (DSCG)). Significantly, we find the orientations of the two LC phases to be coupled, with nematic droplets of 4'-pentyl-4-cyanobiphenyl (5CB) exhibiting a bipolar configuration with an axis of symmetry aligned orthogonal to the far-field director of the DSCG phase. We determine that this coupling of orientations does not result from either anisometric LC droplet shape or interfacial ionic phenomena but rather is consistent with the influence of van der Waals interactions that arise from the anisotropic polarizabilities of nematic 5CB (Δn = +0.18) and DSCG (Δn = -0.02) phases. We also find that it is possible to rotate and uniformly align the nematic droplets by using a weak magnetic field (B ∼ 0.3 T). An analysis of the dynamics of relaxation of the orientations of the 5CB droplets following removal of the magnetic field reveals the DSCG and 5CB droplets to be coupled by energies of ∼10(4) kT, consistent with a simple theoretical estimate of the influence of anisotropic van der Waals interactions. We also observed the nematic 5CB droplets to form dimers and larger assemblies mediated by the elasticity of the nematic DSCG. Overall, these results reveal that LC-in-LC emulsions define a new class of hierarchically ordered soft matter in which both thermotropic and lyotropic LCs are coupled in their ordering. PMID:25278032

  19. Hierarchical Organization in Liquid Crystal-in-Liquid Crystal Emulsions

    PubMed Central

    Mushenheim, Peter C.

    2014-01-01

    We report the formation and characterization of hierarchical ordering in systems comprised of micrometer-sized droplets of thermotropic nematic liquid crystals (LCs) dispersed in continuous nematic phases of a lyotropic chromonic LC (disodium cromoglycate (DSCG)). Significantly, we find the orientations of the two LC phases to be coupled, with nematic droplets of 4′-pentyl-4-cyanobiphenyl (5CB) exhibiting a bipolar configuration with an axis of symmetry aligned orthogonal to the far-field director of the DSCG phase. We determine that this coupling of orientations does not result from either anisometric LC droplet shape or interfacial ionic phenomena but rather is consistent with the influence of van der Waals interactions that arise from the anisotropic polarizabilities of nematic 5CB (Δn = + 0.18) and DSCG (Δn = − 0.02) phases. We also find that it is possible to rotate and uniformly align the nematic droplets by using a weak magnetic field (B ∼ 0.3 T). An analysis of the dynamics of relaxation of the orientations of the 5CB droplets following removal of the magnetic field reveals the DSCG and 5CB droplets to be coupled by energies of ∼104kT, consistent with a simple theoretical estimate of the influence of anisotropic van der Waals interactions. We also observed the nematic 5CB droplets to form dimers and larger assemblies mediated by the elasticity of the nematic DSCG. Overall, these results reveal that LC-in-LC emulsions define a new class of hierarchically ordered soft matter in which both thermotropic and lyotropic LCs are coupled in their ordering. PMID:25278032

  20. [Utilization of organic resources in paper pulp waste liquid].

    PubMed

    Lin, Qiaojia; Liu, Jinghong; Yang, Guidi; Huang, Biao

    2005-04-01

    In this paper, one hundred percent of condensed sulfate paper pulp waste liquid was used as the raw material of adhesive, and the activation of its lignin as well as the improving effects of phenol formaldehyde resin and polyfunctional aqueous polymer isocyanate (PAPI) were studied. The results showed that adding formaldehyde to the waste liquid could increase the reactivity of contained lignin, and adding 30% phenol formaldehyde resin or 20% PAPI could make the waste liquid in place of pure phenol formaldehyde resin for producing class I plywood. Furthermore, the cost could be reduced by 55.5% and 49.0%, respectively, in comparing with pure phenol formaldehyde resin. This approach fully used the organic resources in paper pulp waste liquid, reduced environment pollution at the same time, and had unexceptionable economic, social and ecological benefits. The feasibility of preparing adhesives from paper pulp waste liquid was also analyzed by infrared spectrum. PMID:16011170

  1. Dual Ionic and Organic Nature of Ionic Liquids.

    PubMed

    Shi, Rui; Wang, Yanting

    2016-01-01

    Inherited the advantages of inorganic salts and organic solvents, ionic liquids (ILs) exhibit many superior properties allowing them promising green solvents for the future. Although it has been widely acknowledged that the unique features of ILs originate from their dual ionic and organic nature, its microscopic physical origin still remains blurry. In this work, by comparing the ion/molecule cage structures obtained from molecular dynamics simulations for seven prototypic liquids--a molten inorganic salt, four ILs, a strongly polar organic solvent, and a weakly polar organic solvent, we have revealed that the depth of the cage energy landscape characterizes the ionic nature of ILs, whereas the slope and curvature of its mimimum determine the organic nature of ILs. This finding advances our understanding of ILs and thus will help their efficient utilization as well as the systematic design of novel functionalized ILs. PMID:26782660

  2. NOCHAR Polymers: An Aqueous and Organic Liquid Solidification Process for Cadarache LOR (Liquides Organiques Radioactifs) - 13195

    SciTech Connect

    Vaudey, Claire-Emilie; Renou, Sebastien; Porco, Julien; Kelley, Dennis; Cochaud, Chantal

    2013-07-01

    To handle the Very Low Level Waste (VLLW) and the Low Level Waste (LLW) in France, two options can be considered: the incineration at CENTRACO facility and the disposal facility on ANDRA sites. The waste acceptance in these radwaste routes is dependent upon the adequacy between the waste characteristics (physical chemistry and radiological) and the radwaste route specifications. If the waste characteristics are incompatible with the radwaste route specifications (presence of significant quantities of chlorine, fluorine, organic component etc or/and high activity limits), it is necessary to find an alternative solution that consists of a waste pre-treatment process. In the context of the problematic Cadarache LOR (Liquides Organiques Radioactifs) waste streams, two radioactive scintillation cocktails have to be treated. The first one is composed of organic liquids at 13.1 % (diphenyloxazol, mesitylene, TBP, xylene) and water at 86.9 %. The second one is composed of TBP at 8.6 % and water at 91.4 %. They contain chlorine, fluorine and sulphate and have got alpha/beta/gamma spectra with mass activities equal to some kBq.g{sup -1}. Therefore, tritium is present and creates the second problematic waste stream. As a consequence, in order for disposal acceptance at the ANDRA site, it is necessary to pre-treat the waste. The NOCHAR polymers as an aqueous and organic liquid solidification process seem to be an adequate solution. Indeed, these polymers constitute an important variety of products applied to the treatment of radioactive aqueous and organic liquids (solvent, oil, solvent/oil mixing etc) and sludge through a mechanical and chemical solidification process. For Cadarache LOR, N910 and N960 respectively dedicated to the organic and aqueous liquids solidification are considered. With the N910, the organic waste solidification occurs in two steps. As the organic liquid travels moves through the polymer strands, the strands swell and immobilise the liquid. Then as the

  3. Dual Ionic and Organic Nature of Ionic Liquids

    PubMed Central

    Shi, Rui; Wang, Yanting

    2016-01-01

    Inherited the advantages of inorganic salts and organic solvents, ionic liquids (ILs) exhibit many superior properties allowing them promising green solvents for the future. Although it has been widely acknowledged that the unique features of ILs originate from their dual ionic and organic nature, its microscopic physical origin still remains blurry. In this work, by comparing the ion/molecule cage structures obtained from molecular dynamics simulations for seven prototypic liquids—a molten inorganic salt, four ILs, a strongly polar organic solvent, and a weakly polar organic solvent, we have revealed that the depth of the cage energy landscape characterizes the ionic nature of ILs, whereas the slope and curvature of its mimimum determine the organic nature of ILs. This finding advances our understanding of ILs and thus will help their efficient utilization as well as the systematic design of novel functionalized ILs. PMID:26782660

  4. Dual Ionic and Organic Nature of Ionic Liquids

    NASA Astrophysics Data System (ADS)

    Shi, Rui; Wang, Yanting

    2016-01-01

    Inherited the advantages of inorganic salts and organic solvents, ionic liquids (ILs) exhibit many superior properties allowing them promising green solvents for the future. Although it has been widely acknowledged that the unique features of ILs originate from their dual ionic and organic nature, its microscopic physical origin still remains blurry. In this work, by comparing the ion/molecule cage structures obtained from molecular dynamics simulations for seven prototypic liquids—a molten inorganic salt, four ILs, a strongly polar organic solvent, and a weakly polar organic solvent, we have revealed that the depth of the cage energy landscape characterizes the ionic nature of ILs, whereas the slope and curvature of its mimimum determine the organic nature of ILs. This finding advances our understanding of ILs and thus will help their efficient utilization as well as the systematic design of novel functionalized ILs.

  5. Quasiparticles and Fermi liquid behaviour in an organic metal

    PubMed Central

    Kiss, T.; Chainani, A.; Yamamoto, H.M.; Miyazaki, T.; Akimoto, T.; Shimojima, T.; Ishizaka, K.; Watanabe, S.; Chen, C.-T.; Fukaya, A.; Kato, R.; Shin, S.

    2012-01-01

    Many organic metals display exotic properties such as superconductivity, spin-charge separation and so on and have been described as quasi-one-dimensional Luttinger liquids. However, a genuine Fermi liquid behaviour with quasiparticles and Fermi surfaces have not been reported to date for any organic metal. Here, we report the experimental Fermi surface and band structure of an organic metal (BEDT-TTF)3Br(pBIB) obtained using angle-resolved photoelectron spectroscopy, and show its consistency with first-principles band structure calculations. Our results reveal a quasiparticle renormalization at low energy scales (effective mass m*=1.9 me) and ω2 dependence of the imaginary part of the self energy, limited by a kink at ~50 meV arising from coupling to molecular vibrations. The study unambiguously proves that (BEDT-TTF)3Br(pBIB) is a quasi-2D organic Fermi liquid with a Fermi surface consistent with Shubnikov-de Haas results. PMID:23011143

  6. Distinctive Nanoscale Organization of Dicationic versus Monocationic Ionic Liquids

    SciTech Connect

    Li, Song; Feng, Guang; Banuelos, Jose Leo; Rother, Gernot; Fulvio, Pasquale F; Dai, Sheng; Cummings, Peter T

    2013-01-01

    The distinctive structural organization of dicationic ionic liquids (DILs) with varying alkyl linkage chain lengths is systematically investigated using classical molecular dynamics (MD) simulations. In comparison with their counterparts, monocationic ionic liquids (MILs) with free alkyl chain, the DILs with short linkage chains exhibit almost identical structural features regardless of anion types, whereas the long-chain DILs display a relatively insignificant prepeak and low heterogeneity order parameter (HOP), which is accompanied by the less evident structural heterogeneity. Moreover, the predominant role of anion type in the structure of DILs was verified, similar to what is observed in MILs. Finally, the different nanoscale organizations in DILs and MILs are rationalized by the relatively unfavorable straight and folded chain models proposed for the nanoaggregates in DILs and the favorable micelle-like arrangement for those in MILs.

  7. Gas-liquid chromatography in lunar organic analysis.

    NASA Technical Reports Server (NTRS)

    Gehrke, C. W.

    1972-01-01

    Gas-liquid chromatography (GLC) is a powerful and sensitive method for the separation and detection of organic compounds at nanogram levels. The primary requirement for successful analyses is that the compounds of interest must be volatile under the chromatographic conditions employed. Nonvolatile organic compounds must be converted to volatile derivatives prior to analysis. The derivatives of choice must be both amenable to chromatographic separation and be relatively stable. The condition of volatility necessitates the development of efficient derivatization reactions for important groups of compounds as amino acids, carbohydrates, nucleosides, etc. Trimethylsilylation and trifluoroacetylation represent specific areas of recent prominence. Some relevant practical aspects of GLC are discussed.

  8. Variation in pH of Model Secondary Organic Aerosol during Liquid-Liquid Phase Separation.

    PubMed

    Dallemagne, Magda A; Huang, Xiau Ya; Eddingsaas, Nathan C

    2016-05-12

    The majority of atmospheric aerosols consist of both organic and inorganic components. At intermediate relative humidity (RH), atmospheric aerosol can undergo liquid-liquid phase separation (LLPS) in which the organic and inorganic fractions segregate from each other. We have extended the study of LLPS to the effect that phase separation has on the pH of the overall aerosols and the pH of the individual phases. Using confocal microscopy and pH sensitive dyes, the pH of internally mixed model aerosols consisting of polyethylene glycol 400 and ammonium sulfate as well as the pH of the organic fraction during LLPS have been directly measured. During LLPS, the pH of the organic fraction was observed to increase to 4.2 ± 0.2 from 3.8 ± 0.1 under high RH when the aerosol was internally mixed. In addition, the high spatial resolution of the confocal microscope allowed us to characterize the composition of each of the phases, and we have observed that during LLPS the organic shell still contains large quantities of water and should be characterized as an aqueous organic-rich phase rather than simply an organic phase. PMID:27082856

  9. Assay of organic liquid contents in predominantly water-wet unconsolidated porous media

    NASA Astrophysics Data System (ADS)

    Cary, J. W.; McBride, J. F.; Simmons, C. S.

    1991-11-01

    Immiscible organic liquids may be extracted from moist soil or other hydrophilic porous media by shaking a suspension of water and soil in a glass jar with a piece of porous polyethylene. The water displaces the organic liquid from the predominantly hydrophilic sample and the hydrophobic polyethylene preferentially absorbs the organic liquid, excluding water unless there is a detergent associated with the organic. Because most soils have some hydrophobic surfaces, the extraction of organic liquids by displacement with water is not quite complete. A correction is therefore made in the assay method by including samples with known organic liquid content as controls. The amount of organic liquid not displaced from the control samples can also be used to indicate the extent of hydrophobic sites in predominantly water-wet porous media. Organic liquid extractions were made by using three soils and two organic liquids. The standard deviation among replicated extractions was 0.010 g organic liquid. By applying a correction to the mass of organic liquid recovered, the assay accuracy was ±0.001 g organic liquid/g soil with 20.0-g oven-dry soil samples. It is likely that this assay method could be scaled up and used as a remediation method for removing and recovering organic liquids from earth excavated from spill or leak sites.

  10. Liquid crystals for organic thin-film transistors

    NASA Astrophysics Data System (ADS)

    Iino, Hiroaki; Usui, Takayuki; Hanna, Jun-Ichi

    2015-04-01

    Crystalline thin films of organic semiconductors are a good candidate for field effect transistor (FET) materials in printed electronics. However, there are currently two main problems, which are associated with inhomogeneity and poor thermal durability of these films. Here we report that liquid crystalline materials exhibiting a highly ordered liquid crystal phase of smectic E (SmE) can solve both these problems. We design a SmE liquid crystalline material, 2-decyl-7-phenyl-[1]benzothieno[3,2-b][1]benzothiophene (Ph-BTBT-10), for FETs and synthesize it. This material provides uniform and molecularly flat polycrystalline thin films reproducibly when SmE precursor thin films are crystallized, and also exhibits high durability of films up to 200 °C. In addition, the mobility of FETs is dramatically enhanced by about one order of magnitude (over 10 cm2 V-1 s-1) after thermal annealing at 120 °C in bottom-gate-bottom-contact FETs. We anticipate the use of SmE liquid crystals in solution-processed FETs may help overcome upcoming difficulties with novel technologies for printed electronics.

  11. Group extraction of organic compounds present in liquid samples

    NASA Technical Reports Server (NTRS)

    Jahnsen, Vilhelm J. (Inventor)

    1976-01-01

    An extraction device is disclosed comprising a tube containing a substantially inert, chemically non-reactive packing material with a large surface area to volume ratio. A sample which consists of organic compounds dissolved in a liquid, is introduced into the tube. As the sample passes through the packing material it spreads over the material's large surface area to form a thin liquid film which is held on the packing material in a stationary state. A particular group or family of compounds is extractable from the sample by passing a particular solvent system consisting of a solvent and selected reagents through the packing material. The reagents cause optimum conditions to exist for the compounds of the particular family to pass through the phase boundary between the sample liquid and the solvent of the solvent system. Thus, the compounds of the particular family are separated from the sample liquid and become dissolved in the solvent of the solvent system. The particular family of compounds dissolved in the solvent, representing an extract, exits the tube together with the solvent through the tube's nozzle, while the rest of the sample remains on the packing material in a stationary state. Subsequently, a different solvent system may be passed through the packing material to extract another family of compounds from the remaining sample on the packing material.

  12. The aquatic impact of ionic liquids on freshwater organisms.

    PubMed

    Costa, Susana P F; Pinto, Paula C A G; Saraiva, M Lúcia M F S; Rocha, Fábio R P; Santos, Joyce R P; Monteiro, Regina T R

    2015-11-01

    Ionic liquids (ILs), also known as liquid electrolytes, are powerful solvents with a wide variety of academic and industrial applications. Bioassays with aquatic organisms constitute an effective tool for the evaluation of ILs' toxicity, as well as for the prediction and identification of possible moieties that act as toxicophores. In this work, the acute toxicity of six ILs and two commonly used organic solvents was evaluated using freshwater organisms: Daphnia magna, Raphidocelis subcapitata and Hydra attenuata. The bioassays were performed by exposing the organisms to increasing concentrations of the ILs and observing D. magna immobilization, R. subcapitata growth inhibition, and the morphological or mortality effects in H. attenuata. The results demonstrate that the tested organisms are not equally susceptible to the ILs, e.g., bmpyr [BF4] was the least toxic compound for R. subcapitata, N1,1 [N1,1,1OOH] for D. magna and emim [Tf2N] for H. attenuata. This highlights the importance of applying a battery of assays in toxicological analysis. Additionally, Hydra proved to be the most tolerant species to the tested ILs. According to their hazard rankings, the tested ILs are considered practically harmless or moderately toxic, except (Hex)3(TDec)P [Cl], which was classified as highly toxic. The ILs were revealed to be more harmful to aquatic systems than the tested organic solvents, reaffirming the need to analyze carefully the (eco)toxicological impact of these compounds. The present study provides additional data in the evaluation of the potential hazard and the impact of ILs in the environment. PMID:26151376

  13. Thermochemical Energy Storage through De/Hydrogenation of Organic Liquids: Reactions of Organic Liquids on Metal Hydrides.

    PubMed

    Ulmer, Ulrich; Cholewa, Martin; Diemant, Thomas; Bonatto Minella, Christian; Dittmeyer, Roland; Behm, R Jürgen; Fichtner, Maximilian

    2016-06-01

    A study of the reactions of liquid acetone and toluene on transition metal hydrides, which can be used in thermal energy or hydrogen storage applications, is presented. Hydrogen is confined in TiFe, Ti0.95Zr0.05Mn1.49V0.45Fe0.06 ("Hydralloy C5"), and V40Fe8Ti26Cr26 after contact with acetone. Toluene passivates V40Fe8Ti26Cr26 completely for hydrogen desorption while TiFe is only mildly deactivated and desorption is not blocked at all in the case of Hydralloy C5. LaNi5 is inert toward both organic liquids. Gas chromatography (GC) investigations reveal that CO, propane, and propene are formed during hydrogen desorption from V40Fe8Ti26Cr26 in liquid acetone, and methylcyclohexane is formed in the case of liquid toluene. These reactions do not occur if dehydrogenated samples are used, which indicates an enhanced surface reactivity during hydrogen desorption. Significant amounts of carbon-containing species are detected at the surface and subsurface of acetone- and toluene-treated V40Fe8Ti26Cr26 by X-ray photoelectron spectroscopy (XPS). The modification of the surface and subsurface chemistry and the resulting blocking of catalytic sites is believed to be responsible for the containment of hydrogen in the bulk. The surface passivation reactions occur only during hydrogen desorption of the samples. PMID:27183004

  14. Method for controlling viscosity of organic liquid and compositions

    SciTech Connect

    Kitano, K.; Duvdevani, I.; Schulz, D.N.

    1989-11-14

    This patent describes a method of viscosifying an organic liquid from about 10 to about 10,000 cps for polymer concentrations of less than about 10.0 wt.%. The method comprises adding a sufficient quantity of a hydrolyzed ester containing copolymer of an alpha-olefin and a vinyl alkylenecarboxylil acid copolymerized in the presence of a Ziegler-Natta catalyst having an acid content of from about 0.01 to 10 mole percent and a molecular weight of about 100,000 to about 10,000,000.

  15. Comparison of capillary pressure relationships of organic liquid water systems containing an organic acid or base

    NASA Astrophysics Data System (ADS)

    Lord, D. L.; Demond, A. H.; Hayes, K. F.

    2005-04-01

    The presence of surface-active solutes such as organic acids and bases may have a profound influence on the transport of organic liquid contaminants through their impact on the constitutive relationship of capillary pressure vs. saturation. This relationship is a function of the interfacial tension and wettability of the system, which, in turn, depend on the pH and the concentration of organic acids and bases that are present. This study examines the impact of pH and the concentration on the interfacial tension, contact angle, and capillary pressure of systems consisting of tetrachloroethylene, water, and quartz containing either octanoic acid or dodecylamine. In general, the ionic form of the solute tended to remain in the aqueous phase and reduced the capillary pressure through its impact on the interfacial tension and contact angle; on the other hand, the neutral form of the solute partitioned into the organic liquid phase and had a lesser impact on the capillary pressure for the same total mass of solute. A comparison of these data with data generated in previous research in similar systems where o-xylene was the organic liquid showed that the trends are analogous. Thus, the behavior of these two solvent systems seems to be driven primarily by the aqueous phase speciation of the solute, and the differences between the capillary pressure relationships for the two systems could be attributed to the pure system interfacial tension.

  16. Positronium signature in organic liquid scintillators for neutrino experiments

    SciTech Connect

    Franco, D.; Consolati, G.; Trezzi, D.

    2011-01-15

    Electron antineutrinos are commonly detected in liquid scintillator experiments via inverse {beta} decay by looking at the coincidence between the reaction products: neutrons and positrons. Prior to positron annihilation, an electron-positron pair may form an orthopositronium (o-Ps) state, with a mean lifetime of a few nanoseconds. Even if the o-Ps decay is speeded up by spin-flip or pick-off effects, it may introduce distortions in the photon emission time distribution, crucial for position reconstruction and pulse shape discrimination algorithms in antineutrino experiments. Reversing the problem, the o-Ps-induced time distortion represents a new signature for tagging antineutrinos in liquid scintillator. In this article, we report the results of measurements of the o-Ps formation probability and lifetime for the most used solvents for organic liquid scintillators in neutrino physics (pseudocumene, linear alkyl benzene, phenylxylylethane, and dodecane). We characterize also a mixture of pseudocumene +1.5 g/l of 2,5-diphenyloxazole, a fluor acting as wavelength shifter. In the second part of the article, we demonstrate that the o-Ps-induced distortion of the scintillation photon emission time distributions represent an optimal signature for tagging positrons on an event by event basis, potentially enhancing the antineutrino detection.

  17. Liquid templating for nanoparticle organization into complex patterns.

    PubMed

    Rezende, Camila A; Lee, Lay-Theng; Galembeck, Fernando

    2007-02-27

    Dewetting of thin films of charged polymer solutions produces complex patterns that can be applied to direct nanoparticle organization on solid substrates. The morphology produced by dewetting can be controlled by the solution properties, temperature, and substrate wetting. In this work, new results on this liquid-template self-assembly system are presented, with special emphasis on producing large arrays of organized nanoparticles. On a hydrophilic substrate with complete wetting, the patterns include polygonal networks and parallel-track arrays that extend over several hundreds of microns. These large structures are formed under well-controlled drying conditions and characterized by scanning electron microscopy, which is better suited for the examination of large as well as small areas than atomic force microscopy. On partial wetting substrates, new patterns are observed, including a complex set of parallel curved bands with variable particle number densities. PMID:17309221

  18. Poly(ionic liquid) superabsorbent for polar organic solvents.

    PubMed

    Horne, W Jeffrey; Andrews, Mary A; Terrill, Kelsey L; Hayward, Spenser S; Marshall, Jeannie; Belmore, Kenneth A; Shannon, Matthew S; Bara, Jason E

    2015-05-01

    A simple, polymerized ionic liquid (poly(IL)) based on methylimidazolium cations tethered to a polystyrene backbone exhibits superabsorbent behavior toward polar organic solvents, most notably propylene carbonate (PC) and dimethyl sulfoxide (DMSO), wherein the poly(IL) was observed to swell more than 390 and 200 times (w/w) its original mass, yet absorbs negligible quantities of water, hexanes, and other solvents, many of which were miscible with the IL monomer. Although solubility parameters and dielectric constants are typically used to rationalize such behaviors, we find that poly(IL)-solvent compatibility is most clearly correlated to solvent dipole moment. Poly(IL) superabsorbency is not reliant upon the addition of a cross-linking agent. PMID:25893981

  19. Removal of organic impurities from liquid carbon dioxide

    NASA Astrophysics Data System (ADS)

    Zito, Richard R.

    2002-09-01

    The use of a high velocity stream of carbon dioxide snowflakes to clean large optics is well known, and has gained widespread acceptance in the astronomical community as a telescope maintenance technique. Ultimately, however, the success of carbon dioxide snow cleaning depends on the availability of high purity carbon dioxide. The higher the purity of the carbon dioxide, the longer will be the time interval between required mirror washings. The highest grades of commercially produced liquid carbon dioxide are often not available in the more remote regions of the world - such as where major astronomical observatories are often located. Furthermore, the purity of even the highest grades of carbon dioxide are only nominal, and wide variations are known to occur from tank to tank. Occasionally, visible deposits of organic impurities are left behind during cleaning with carbon dioxide that is believed to be 99.999% pure. A zeolite molecular sieve based filtration system has proven to be very effective in removing these organic impurities. A zeolite is a complex alumino-silicate. One example has an empirical formula of Na2O(Al2O3)(SiO2)2yH2O, where y=0 to 8. The zeolites have an open crystal structure and are capable of trapping impurities like 8-methylheptadecane (an oil) and 2,6-octadine-1-ol,3,7- dimethyl-,(E)- (a fatty acid). In fact, a zeolite can trap 29.5% of its own weight in SAE 20 lubricant at 25 degree(s)C. After filtration of liquid CO2 through zeolites, the concentration of measured impurities was below the detection limit for state-of-the-art gas chromatography systems.

  20. Catalytic conversion of nonfood woody biomass solids to organic liquids.

    PubMed

    Barta, Katalin; Ford, Peter C

    2014-05-20

    This Account outlines recent efforts in our laboratories addressing a fundamental challenge of sustainability chemistry, the effective utilization of biomass for production of chemicals and fuels. Efficient methods for converting renewable biomass solids to chemicals and liquid fuels would reduce society's dependence on nonrenewable petroleum resources while easing the atmospheric carbon dioxide burden. The major nonfood component of biomass is lignocellulose, a matrix of the biopolymers cellulose, hemicellulose, and lignin. New approaches are needed to effect facile conversion of lignocellulose solids to liquid fuels and to other chemical precursors without the formation of intractable side products and with sufficient specificity to give economically sustainable product streams. We have devised a novel catalytic system whereby the renewable feedstocks cellulose, organosolv lignin, and even lignocellulose composites such as sawdust are transformed into organic liquids. The reaction medium is supercritical methanol (sc-MeOH), while the catalyst is a copper-doped porous metal oxide (PMO) prepared from inexpensive, Earth-abundant starting materials. This transformation occurs in a single stage reactor operating at 300-320 °C and 160-220 bar. The reducing equivalents for these transformations are derived by the reforming of MeOH (to H2 and CO), which thereby serves as a "liquid syngas" in the present case. Water generated by deoxygenation processes is quickly removed by the water-gas shift reaction. The Cu-doped PMO serves multiple purposes, catalyzing substrate hydrogenolysis and hydrogenation as well as the methanol reforming and shift reactions. This one-pot "UCSB process" is quantitative, giving little or no biochar residual. Provided is an overview of these catalysis studies beginning with reactions of the model compound dihydrobenzofuran that help define the key processes occurring. The initial step is phenyl-ether bond hydrogenolysis, and this is followed by

  1. Organic liquid scintillation detector shape and volume impact on radiation portal monitors

    NASA Astrophysics Data System (ADS)

    Paff, Marc G.; Clarke, Shaun D.; Pozzi, Sara A.

    2016-07-01

    We have developed and tested a radiation portal monitor using organic liquid scintillation detectors. In order to optimize our system designs, neutron measurements were carried out with three organic liquid scintillation detectors of different shapes and sizes, along with a 3He radiation portal monitor (RPM) as a reference. The three liquids tested were a 7.62 cm diameter by 7.62 cm length cylindrical active volume organic liquid scintillation detector, a 12.7 cm diameter by 12.7 cm length cylindrical active volume organic liquid scintillation detector, and a 25 cm by 25 cm by 10 cm "paddle" shaped organic liquid scintillation detector. Background and Cf-252 neutron measurements were recorded to allow for a comparison of neutron intrinsic efficiencies as well as receiver operating characteristics (ROC) curves between detectors. The 12.7 cm diameter cylindrical active volume organic liquid scintillation detector exhibited the highest intrinsic neutron efficiency (54%) of all three liquid scintillators. An ROC curve analysis for a heavily moderated Cf-252 measurement showed that using the 12.7 cm diameter by 12.7 cm length cylindrical active volume Eljen EJ309 organic liquid scintillation detector would result in the fewest needed detector units in order to achieve a near 100% positive neutron alarm rate while maintaining a better than 1 in 10,000 false alarm rate on natural neutron background. A small number of organic liquid scintillation detectors could therefore be a valid alternative to 3He in some RPM applications.

  2. Reactive Uptake of Ammonia and Formation of Organic Nitrogen Species for Non-Liquid/Liquid Secondary Organic Material

    NASA Astrophysics Data System (ADS)

    Martin, S. T.; Li, Y.; Liu, P.

    2015-12-01

    Formation of ammonium and organic nitrogen (ON) species was studied for secondary organic material (SOM) of variable viscosity, ranging from non-liquid to liquid physical states. The SOM was produced as particles of 50 to 150 nm in diameter in aerosol form from six precursors, including three terpenoid and three aromatic species. The viscosity of the hygroscopic SOM was adjusted by exposure to relative humidity (RH) from <5% to >90% RH in steps of 10% at 293 ± 2 K. The aerosol was subsequently exposed to 5 ppm NH3 for mean reaction times of 30, 370, or 5230 s. Ammonium and ON were characterized by high-resolution time-of-flight aerosol mass spectrometry (HR-ToF-AMS). The ammonium-to-organic ratio of mass concentrations (MNH4/MOrg) in the particles increased monotonically from <5% RH to a limiting value at a threshold RH, implicating a switchover in the reaction kinetics from a system limited by diffusivity within the SOM for low RH to one limited by other factors, such as saturated uptake, at higher RH. Formation of ON was observed for aromatic-derived SOMs, but not significant for terpenoid-derived SOMs. For aromatic-derived SOMs, the ON-to-organic ratio of mass concentrations (MON/MOrg) was negligible for RH <20%, increased monotonically from 20% to 60% RH, and stayed constant for RH >60%. The threshold RH for the switchover from kinetically controlled regime to a non-kinetically-controlled one was thus different between formation of ammonium and ON. This difference suggests that water may play a role in the slow reactions of ON formation as a reactant or a catalyst, in addition to affecting the reactant diffusion as in the fast reaction of ammonium formation. The implication is that formation of ammonium salts and organic nitrogen species by certain SOMs should be treated separately in chemical transport models to reflect the different roles of water that may affect the phase state of the SOMs or may act as a reactant or a catalyst.

  3. Investigation of the organic matter in inactive nuclear tank liquids. Environmental Restoration Program

    SciTech Connect

    Schenley, R.L.; Griest, W.H.

    1990-08-01

    Environmental Protection Agency (EPA) methodology for regulatory organics fails to account for the organic matter that is suggested by total organic carbon (TOC) analysis in the Oak Ridge National Laboratory (ORNL) inactive nuclear waste-tank liquids and sludges. Identification and measurement of the total organics are needed to select appropriate waste treatment technologies. An initial investigation was made of the nature of the organics in several waste-tank liquids. This report details the analysis of ORNL wastes.

  4. Azobenzene-based organic salts with ionic liquid and liquid crystalline properties

    DOE PAGESBeta

    Stappert, Kathrin; Muthmann, Johanna; Spielberg, Eike T.; Mudring, Anja -Verena

    2015-07-23

    Two sets of new azobenzene-based bromide salts are synthesized, and their thermal photochromic properties are studied. Both sets are based on the imidazolium cation. The first set (1) features a symmetric biscation where two imidazolium head groups (Im) with different alkyl chains (Cn) are connected to a central azobenzene unit (Azo): [Azo(C1-Im-Cn)2]; n = 6, 8, 10, 12, 14. The other one contains an n-alkyl-imidazolium cation (Cn-Im) bearing a terminal azobenzene unit (C1-Azo) substituted with an alkoxy chain (O-Cm) of either two (2) or six (3) carbon atoms: [C1-Azo-O-Cm-Im-Cn]; m = 2, n = 8, 10, 12 and m =more » 6, n = 8, 10, 12, 14, 16. For both cation classes, the influence of alkyl chains of varying length on the thermal phase behavior was investigated by differential scanning calorimetry (DSC) and polarizing optical microscopy (POM). For five compounds (Azo(-C1-Im-C12)2 (1d), Azo(-C1-Im-C12)2 (1e), C1-Azo-O-C2-Im-C10 (2b), C1-Azo-O-C2-Im-C12 (2c), and C1-Azo-O-C6-Im-C16 (3e)), the formation of a liquid crystalline phase was observed. The biscationic salts (1) are all comparatively high melting organic salts (180–240 °C), and only the two representatives with long alkylchains (C12 and C14) exhibit liquid crystallinity. The monocationic salts with an O–C2 bridge (2) melt between 140 and 170 °C depending on the alkyl chain length, but from an alkyl chain of 10 and more carbon atoms on they form a smectic A liquid crystalline phase. The representatives of the third set with a O–C6 bridge qualify as ionic liquids with melting points less than 100 °C. However, only the representative with a hexadecyl chain forms a liquid crystalline phase. Representative single crystals for all sets of cations could be grown that allowed for single crystal structure analysis. Together with small-angle X-ray scattering experiments they allow for a more detailed understanding of the thermal properties. As a result, through irradiation with UV-light (320–366 nm) all

  5. Azobenzene-based organic salts with ionic liquid and liquid crystalline properties

    SciTech Connect

    Stappert, Kathrin; Muthmann, Johanna; Spielberg, Eike T.; Mudring, Anja -Verena

    2015-07-23

    Two sets of new azobenzene-based bromide salts are synthesized, and their thermal photochromic properties are studied. Both sets are based on the imidazolium cation. The first set (1) features a symmetric biscation where two imidazolium head groups (Im) with different alkyl chains (Cn) are connected to a central azobenzene unit (Azo): [Azo(C1-Im-Cn)2]; n = 6, 8, 10, 12, 14. The other one contains an n-alkyl-imidazolium cation (Cn-Im) bearing a terminal azobenzene unit (C1-Azo) substituted with an alkoxy chain (O-Cm) of either two (2) or six (3) carbon atoms: [C1-Azo-O-Cm-Im-Cn]; m = 2, n = 8, 10, 12 and m = 6, n = 8, 10, 12, 14, 16. For both cation classes, the influence of alkyl chains of varying length on the thermal phase behavior was investigated by differential scanning calorimetry (DSC) and polarizing optical microscopy (POM). For five compounds (Azo(-C1-Im-C12)2 (1d), Azo(-C1-Im-C12)2 (1e), C1-Azo-O-C2-Im-C10 (2b), C1-Azo-O-C2-Im-C12 (2c), and C1-Azo-O-C6-Im-C16 (3e)), the formation of a liquid crystalline phase was observed. The biscationic salts (1) are all comparatively high melting organic salts (180–240 °C), and only the two representatives with long alkylchains (C12 and C14) exhibit liquid crystallinity. The monocationic salts with an O–C2 bridge (2) melt between 140 and 170 °C depending on the alkyl chain length, but from an alkyl chain of 10 and more carbon atoms on they form a smectic A liquid crystalline phase. The representatives of the third set with a O–C6 bridge qualify as ionic liquids with melting points less than 100 °C. However, only the representative with a hexadecyl chain forms a liquid crystalline phase. Representative single crystals for all sets of cations could be grown that allowed for single crystal structure analysis. Together with small-angle X-ray scattering experiments they allow for a more detailed understanding of the thermal properties. As a result, through irradiation with UV

  6. Discotic liquid crystals: a new generation of organic semiconductors.

    PubMed

    Sergeyev, Sergey; Pisula, Wojciech; Geerts, Yves Henri

    2007-12-01

    Discotic (disc-like) molecules typically comprising a rigid aromatic core and flexible peripheral chains have been attracting growing interest because of their fundamental importance as model systems for the study of charge and energy transport and due to the possibilities of their application in organic electronic devices. This critical review covers various aspects of recent research on discotic liquid crystals, in particular, molecular design concepts, supramolecular structure, processing into ordered thin films and fabrication of electronic devices. The chemical structure of the conjugated core of discotic molecules governs, to a large extent, their intramolecular electronic properties. Variation of the peripheral flexible chains and of the aromatic core is decisive for the tuning of self-assembly in solution and in bulk. Supramolecular organization of discotic molecules can be effectively controlled by the choice of the processing methods. In particular, approaches to obtain suitable macroscopic orientations of columnar superstructures on surfaces, that is, planar uniaxial or homeotropic alignment, are discussed together with appropriate processing techniques. Finally, an overview of charge transport in discotic materials and their application in optoelectronic devices is given. PMID:17982517

  7. Incineration of radioactive organic liquid wastes by underwater thermal plasma

    NASA Astrophysics Data System (ADS)

    Mabrouk, M.; Lemont, F.; Baronnet, J. M.

    2012-12-01

    This work deals with incineration of radioactive organic liquid wastes using an oxygen thermal plasma jet, submerged under water. The results presented here are focused on incineration of three different wastes: a mixture of tributylphosphate (TBP) and dodecane, a perfluoropolyether oil (PFPE) and trichloroethylene (TCE). To evaluate the plutonium behavior in used TBP/dodecane incineration, zirconium is used as a surrogate of plutonium; the method to enrich TBP/dodecane mixture in zirconium is detailed. Experimental set-up is described. During a trial run, CO2 and CO contents in the exhaust gas are continuously measured; samples, periodically taken from the solution, are analyzed by appropriate chemical methods: contents in total organic carbon (COT), phosphorus, fluoride and nitrates are measured. Condensed residues are characterized by RX diffraction and SEM with EDS. Process efficiency, during tests with a few L/h of separated or mixed wastes, is given by mineralization rate which is better than 99.9 % for feed rate up to 4 L/h. Trapping rate is also better than 99 % for phosphorous as for fluorine and chlorine. Those trials, with long duration, have shown that there is no corrosion problems, also the hydrogen chloride and fluoride have been neutralized by an aqueous solution of potassium carbonate.

  8. Improvement of natural pastures using liquid organic fertilizers

    NASA Astrophysics Data System (ADS)

    Ghambashidze, Giorgi; Gabedava, Giorgi; Abuladze, Paata

    2016-04-01

    Nowadays natural pastures remains the main source to supply livestock with fresh feed material in Georgia. Due to that common pasturelands are under continues grazing pressure and normally no measures are taken in order to improve pasture productivity and to protect soil from erosion. Unregulated stocking rate leads to overutilization of natural pastures causing reduction in productivity and soil fertility. It is especially evident in arid regions, where bare soil after removal of vegetation dries out and is subject to wind erosion. In many areas even with regulated stocking rate plant available soil nutrient pool is already diminished and vegetation cannot be recovered easily after grazing. Therefore it is essential to improve soil fertility, which provide adequate amount of nutrients to plants to regenerate. Ongoing study aims to compare effect of different types of organic fertilizers on natural pastures in combination with pasture rotation scheme in order to maintain soil fertility and prepare the basis for its gradual improvement. Initial results shows positive impact of liquid organic fertilizers which increased aboveground biomass production by 200-300 kg per hectare.

  9. Material degradation of liquid organic semiconductors analyzed by nuclear magnetic resonance spectroscopy

    SciTech Connect

    Fukushima, Tatsuya; Yamamoto, Junichi; Fukuchi, Masashi; Kaji, Hironori; Hirata, Shuzo; Jung, Heo Hyo; Adachi, Chihaya; Hirata, Osamu; Shibano, Yuki

    2015-08-15

    Liquid organic light-emitting diodes (liquid OLEDs) are unique devices consisting only of liquid organic semiconductors in the active layer, and the device performances have been investigated recently. However, the device degradation, especially, the origin has been unknown. In this study, we show that material degradation occurs in liquid OLEDs, whose active layer is composed of carbazole with an ethylene glycol chain. Nuclear magnetic resonance (NMR) experiments clearly exhibit that the dimerization reaction of carbazole moiety occurs in the liquid OLEDs during driving the devices. In contrast, cleavages of the ethylene glycol chain are not detected within experimental error. The dimerization reaction is considered to be related to the device degradation.

  10. Effects of electrolytes and polarity of organic liquids on the coalescence of droplets at aqueous-organic interfaces

    NASA Astrophysics Data System (ADS)

    Chen, Chao-Tai; Maa, Jer-Ru; Yang, Yu-Min; Chang, Chien-Hsiang

    1998-05-01

    The coalescence rate of aqueous droplets in organic media was studied experimentally. The effects of electrolytes with cations and anions of various valencies, and organic liquids of different polarities were investigated, and the results were compared with coalescence rate data of organic droplets in aqueous media of previous authors. It was found that for the cases of polar organic liquids, the effects of dissolved electrolytes on the coalescence of aqueous droplets in organic media was just the opposite to that of organic droplets in aqueous media. The coalescence rates of aqueous droplets increase and those of organic droplets decrease with the increase of electrolyte concentrations, but in the case of methyl isobutyl ketone, electrolytes of trivalent cations or anions, such as AlCl 3, LaCl 3, FeCl 3 and Na 3P0 4, increase the coalescence rates of aqueous droplets and reduce those of organic droplets strongly only within certain concentration ranges. Their effects are not nearly as pronounced outside these ranges. For the case of nonpolar organic liquids, dissolved electrolytes give no significant effect on the coalescence rates of either aqueous or organic droplets. The effects of electrolytes on the coalescence processes of liquid droplets is not significantly related to the bulk viscosity of the film liquids and the interfacial properties between the phases. It is more likely that these effects are caused by the change of intermolecular forces due to the addition of the electrolytes.

  11. Determination of optimal ionic liquid for organic single-crystal field-effect transistors

    NASA Astrophysics Data System (ADS)

    Ono, S.; Miwa, K.; Seki, S.

    2016-02-01

    We investigate organic single-crystal field-effect transistors with various ionic liquids as gate dielectric. We find that the mobility of the field-effect transistors for both p-type and n-type organic semiconductors increases with decreasing total capacitance of the ionic liquid. However, it does not depend on the ion species at the interface between the organic semiconductor and the ionic liquid. By choosing an appropriate ionic liquid, a high carrier mobility of 12.4 cm2/V s in rubrene single crystals (p-type) and 0.13 cm2/V s in 7.7.8.8-Tetracyanoquinodimethane single crystals (n-type) are achieved. This study clarifies the influence of ionic liquids on the device performance of organic field-effect transistors and shows a way to maximize carrier mobility at the solid/liquid interface.

  12. Multiwalled carbon nanotubes sensor for organic liquid detection at room temperature

    NASA Astrophysics Data System (ADS)

    Chaudhary, Deepti; Khare, Neeraj; Vankar, V. D.

    2016-04-01

    We have explored the possibility of using multiwalled carbon nanotubes (MWCNTs) as room temperature chemical sensor for the detection of organic liquids such as ethanol, propanol, methanol and toluene. MWCNTs were synthesized by thermal chemical vapor deposition (TCVD) technique. The interdigitated electrodes were fabricated by conventional photolithography technique. The sensor was fabricated by drop depositing MWCNT suspension onto the interdigitated electrodes. The sensing properties of MWCNTs sensor was studied for organic liquids detection. The resistance of sensor was found to increase upon exposure to these liquids. Sensor shows good reversibility and fast response at room temperature. Charge transfer between the organic liquid and sensing element is the dominant sensing mechanism.

  13. Calculation of heat conductivity of organic liquids as function of temperature

    SciTech Connect

    Safarov, M.M.; Khadzhidov, Kh.

    1995-12-01

    Results of generalization of experimental data on heat conductivity of a series of organic liquids as a function of temperature at atmospheric pressure are presented. The approximation dependence for calculation of heat conductivity of liquid organic compounds as a function of temperature, normal boiling temperature, and molar mass is obtained.

  14. Development of polyatomic ion beam system using liquid organic materials

    NASA Astrophysics Data System (ADS)

    Takaoka, G. H.; Nishida, Y.; Yamamoto, T.; Kawashita, M.

    2005-08-01

    We have developed a new type of polyatomic ion beam system using liquid organic materials such as octane and ethanol, which consists of a capillary type of nozzle, an ionizer, a mass-separator and a substrate holder. Ion current extracted after ionization was 430 μA for octane and 200 μA for ethanol, respectively. The mass-analysis was realized using a compact E × B mass filter, and the mass-analyzed ion beams were transferred toward the substrate. The ion current density at the substrate was a few μA/cm2 for the mass-separated ion species. Interactions of polyatomic ion beams with silicon (Si) surfaces were investigated by utilizing the ellipsometry measurement. It was found that the damaged layer thickness irradiated by the polyatomic ions with a mass number of about 40 was smaller than that by Ar ion irradiation at the same incident energy and ion fluence. The result indicated that the rupture of polyatomic ions occurred upon its impact on the Si surface with an incident energy larger than a few keV. In addition, the chemical modification of Si surfaces such as wettability could be achieved by adjusting the incident energy for the ethanol ions, which included all the fragment ions.

  15. Tertiary phase diagram of cellulose, ionic liquid and organic solvent

    NASA Astrophysics Data System (ADS)

    Zhang, Xin; Henderson, Doug; Tyagi, Madhusudan; Mao, Yimin; Briber, Robert M.; Wang, Howard

    Cellulose is the most abundant natural polymer on earth, and widely used in products from clothing to paper. Fundamental understanding of molecular solutions of cellulose is the key to realize advanced technologies beyond cellulose fibers. It has been reported that certain ionic liquid/organic solvent mixtures dissolve cellulose. In this study, the tertiary phase diagram of microcrystalline cellulose, 1-Ethyl-3-methylimidazolium acetate (EMIMAc), and dimethylformamide (DMF) mixtures has been determined using optical cloud point method and small angle neutron scattering (SANS). Data indicate that a molar ratio of EMIMAc to cellulose repeating unit equal or greater than 3 is necessary but not sufficient in forming one-phase homogeneous solutions. A miscibility gap exists in the dilute regime, where a minimum of 5 mol% of EMIM Ac in DMF is needed to form homogenous solutions. SANS show that cellulose chains adopt Gaussian-like conformation in homogenous solutions. The solutions exhibit the characteristics of upper critical solution temperature. Clustering of cellulose chains occurs at low EMIMAc/DMF or EMIMAc/cellulose ratio, or at low temperatures. The mechanism of cellulose dissolution in tertiary mixture is discussed.

  16. Mass flow of a volatile organic liquid mixture in soils

    SciTech Connect

    Gerstl, Z.; Galin, Ts.; Yaron, B.

    1994-05-01

    The flow of kerosene, a volatile organic liquid mixture (VOLM), was studied in loam and clay soils and in a medium sand. The kerosene residual capacity and conductivity were determined for all three media at different initial moisture contents and with kerosene of different compositions. The kerosene conductivity of the soil was found to be strongly influenced by the soil texture and initial moisture content as well as by the kerosene composition. The kerosene conductivity of the sand was two orders of magnitude greater than that of the soils and was unaffected by initial moisture contents as high as field capacity. The kerosene conductivity of the loam soil was similar in oven dry and air dry soils, but increased significantly in soils at 70% and fun field capacity due to the Yuster effect. In the clay soil the kerosene conductivity of the air dry sod was four times that of the oven dry sod and increased somewhat in the soil at 70% field capacity. No kerosene flow was observed in the oven dry soil at full field capacity. The differences in kerosene conductivity in these soils and the effect of moisture content were attributed to the different pore-sin distributions of the soil& Changes in the composition of the kerosene due to volatilization of the light fractions resulted in increased viscosity of the residual kerosene. This increased viscosity affected the fluid properties of kerosene, which resulted in decreased kerosene conductivity in the sand and the soils. 29 refs., 4 figs., 4 tabs.

  17. Investigation of the Extinguishing Features for Liquid Fuels and Organic Flammable Liquids Atomized by a Water Flow

    NASA Astrophysics Data System (ADS)

    Voytkov, Ivan V.; Zabelin, Maksim V.; Vysokomornaya, Olga V.

    2016-02-01

    The processes of heat and mass transfer were investigated experimentally while moving and evaporating the atomized water flow in high-temperature combustion products of typical liquid fuels and organic flammable liquids: gasoline, kerosene, acetone, crude oil, industrial alcohol. We determined typical periods of liquid extinguishing by an atomized water flow of various dispersability. Data of the discharge of extinguishing medium corresponding to various parameters of atomization and duration of using the atomization devices was presented. It is shown that Um≈3.5 m/s is a minimal outflow velocity of droplets during moving while passing the distance of 1m in the high-temperature gas medium to stop the combustion of organic liquids.

  18. Ionic Liquid Structure-Induced Effects on Organic Reactions

    NASA Astrophysics Data System (ADS)

    Stark, Annegret

    Understanding the ways in which the constituents of ionic liquids, i.e. the type of cation, its substitution, and the type of anion chosen, interact with reactants is prerequisite to deliberately designing an ionic liquid solvent with optimum performance. Several approaches, including physico-chemical and spectroscopic measurements and computational studies of binary ionic liquid-substrate mixtures have been presented that investigate the strength of interactions.

  19. Molecular model of self diffusion in polar organic liquids: implications for conductivity and fluidity in polar organic liquids and electrolytes.

    PubMed

    Frech, Roger; Petrowsky, Matt

    2014-03-01

    Decades of studying isothermal and temperature-dependent mass and charge transport in polar organic liquids and electrolytes have resulted in two mutually incompatible models and the failure to develop a general molecular level picture. The hydrodynamic model describes conductivity, diffusion, and dielectric relaxation in terms of viscosity, while the inadequacy of the thermal activation model leads to empirical descriptions and fitting procedures whose adjustable parameters have little or no physical significance. We recently demonstrated that transport data can be characterized with a high degree of accuracy and self-consistency using the compensated Arrhenius formalism (CAF), where the transport property of interest assumes an Arrhenius-like form that also includes a dielectric constant dependence in the exponential prefactor. Here, we provide the molecular-level basis for the CAF by first modifying transition state theory, emphasizing the coupling of the diffusing molecule's motion with the dynamical motion of the surrounding matrix. We then explicitly include the polarization energy contribution from the dipolar medium. The polarization energy is related to molecular and system properties through the dipole moment and dipole density, respectively. The energy barrier for transport is coupled to the polarization energy, and we show that accounting for the role of the polarization energy leads naturally to the dielectric constant dependence in the exponential prefactor. PMID:24559237

  20. Surface Tension of Organic Liquids Using the OPLS/AA Force Field.

    PubMed

    Zubillaga, Rafael A; Labastida, Ariana; Cruz, Bibiana; Martínez, Juan Carlos; Sánchez, Enrique; Alejandre, José

    2013-03-12

    Molecular dynamics simulations are performed to obtain the surface tension of 61 organic liquids using the OPLS/AA (all-atom optimized potential for liquid simulations). The force field parameters are the same as those recently used (Caleman et al. J. Chem. Theory Comput.2012, 8, 61) to determine several thermodynamic properties of 146 organic liquids. The correct evaluation of surface tension using slab simulations of liquids requires one to properly take into account the long-range interactions (Trukhymchuk and Alejandre J. Chem. Phys.1999, 111, 8510). In addition, the liquid density from slab simulations has to be the same as that obtained in liquid simulations at constant temperature and pressure. The new results of surface tensions from this work improve those reported by Caleman et al. The OPLS/AA force field gives good surface tensions compared with experimental data for most of the systems studied in this work, although it was developed to simulate liquids. PMID:26587622

  1. Method and apparatus for the removal or bioconversion of constituents of organic liquids

    DOEpatents

    Scott, T.; Scott, C.D.

    1994-10-25

    A method and apparatus are disclosed for the removal or conversion of constituents from bulk organic liquids. A countercurrent biphasic bioreactor system is utilized to disperse and recoalesce a biocatalyst contained in the aqueous liquid phase into the organic liquid phase containing the constituent. Two transient, high-intensity electrical fields rupture the aqueous drops into a plurality of microdroplets and induce continuous coalescence and redispersion as the microdroplets travel through the organic phase, thus increasing surface area. As the aqueous microdroplets progress through the organic phase, the biocatalyst then reacts with the constituent to produce a product which is then removed from the bioreactor in the aqueous phase or retained in the organic phase. The organic liquid, now free of the original constituents, is ready for immediate use or further processing. 1 fig.

  2. Method and apparatus for the removal of bioconversion of constituents of organic liquids

    DOEpatents

    Scott, Timothy; Scott, Charles D.

    1994-01-01

    A method and apparatus for the removal or conversion of constituents from bulk organic liquids. A countercurrent biphasic bioreactor system is utilized to disperse and recoalesce a biocatalyst contained in the aqueous liquid phase into the organic liquid phase containing the constituent. Two transient, high-intensity electrical fields rupture the aqueous drops into a plurality of microdroplets and induce continuous coalescence and redispersion as the microdroplets travel through the organic phase, thus increasing surface area. As the aqueous microdroplets progress through the organic phase, the biocatalyst then reacts with the constituent to produce a product which is then removed from the bioreactor in the aqueous phase or retained in the organic phase. The organic liquid, now free of the original constituents, is ready for immediate use or further processing.

  3. Inorganic or organic azide-containing hypergolic ionic liquids.

    PubMed

    Joo, Young-Hyuk; Gao, Haixiang; Zhang, Yanqiang; Shreeve, Jean'ne M

    2010-04-01

    Recently extensive research has focused on replacing toxic hydrazine, monomethylhydrazine, and unsymmetrical dimethylhydrazine as liquid propellant fuels. 2-Azido-N,N-dimethylethylamine (1) is a good candidate to replace hydrazine derivatives in certain hypergolic fuel applications. Energetic ionic liquids that contain the 2-azido-N,N,N-trimethylethylammonium cation with nitrocyanamide, dicyanamide, dinitramide, or azide anion have been successfully synthesized in good yields by metathesis reactions. Ionic liquids have received considerable attention as energetic materials. The replacement of hydrazine with tertiary ammonium salts is especially attractive since many ionic liquids are models for green chemistry. In this work, new azide-functionalized ionic liquids are demonstrated to exhibit hypergolic activity with such oxidizers as 100% nitric acid or nitrogen tetraoxide (NTO). PMID:20175509

  4. Partition coefficients of organic compounds in new imidazolium based ionic liquids using inverse gas chromatography.

    PubMed

    Revelli, Anne-Laure; Mutelet, Fabrice; Jaubert, Jean-Noël

    2009-06-01

    Partition coefficients of organic compounds in four ionic liquids: 1-ethanol-3-methylimidazolium tetrafluoroborate, 1-ethanol-3-methylimidazolium hexafluorophosphate, 1,3-dimethylimidazolium dimethylphosphate and 1-ethyl-3-methylimidazolium diethylphosphate were measured using inverse gas chromatography from 303.3 to 332.55K. The influence of gas-liquid and gas-solid interfacial adsorption of different solutes on ionic liquids was also studied. Most of the polar solutes were retained largely by partition while light hydrocarbons were retained predominantly by interfacial adsorption on the ionic liquids studied in this work. The solvation characteristics of the ionic liquids were evaluated using the Abraham solvation parameter model. PMID:19414174

  5. General nature of liquid-liquid transition in aqueous organic solutions

    NASA Astrophysics Data System (ADS)

    Murata, Ken-Ichiro; Tanaka, Hajime

    2013-11-01

    The presence or absence of a liquid-liquid transition in water is one of the hot topics in liquid science, and while a liquid-liquid transition in water/glycerol mixtures is known, its generality in aqueous solutions has remained elusive. Here we reveal that 14 aqueous solutions of sugar and polyol molecules, which have an ability to form hydrogen bonding with water molecules, exhibit liquid-liquid transitions. We find evidence that both melting of ice and liquid-liquid transitions in all these aqueous solutions are controlled solely by water activity, which is related to the difference in the chemical potential between an aqueous solution and pure water at the same temperature and pressure. Our theory shows that water activity is determined by the degree of local tetrahedral ordering, indicating that both phenomena are driven by structural ordering towards ice-like local structures. This has a significant implication on our understanding of the low-temperature behaviour of water.

  6. Strongly Dichroic Organic Films via Controlled Assembly of Modular Aromatic Charge-Transfer Liquid Crystals.

    PubMed

    Bé, Ariana Gray; Tran, Cheryl; Sechrist, Riley; Reczek, Joseph J

    2015-10-01

    The formation of highly anisotropic organic thin films based on the designed self-assembly of mixed-stack liquid crystals is reported. A series of alkoxyanthracene donors is combined in a modular fashion with a naphthalenediimide acceptor to generate new charge-transfer columnar liquid crystals. Materials characterization and molecular modeling provides insight into structure-function relationships in these organic materials that lead to the striking bulk dichroic properties of certain molecular assemblies. PMID:26375256

  7. Using FT-IR Spectroscopy to Measure Charge Organization in Ionic Liquids

    PubMed Central

    Burba, Christopher M.; Janzen, Jonathan; Butson, Eric D.; Coltrain, Gage L.

    2013-01-01

    A major goal in the field of ionic liquids is correlating transport property trends with the underlying liquid structure of the compounds, such as the degree of charge organization among the constituent ions. Traditional techniques for experimentally assessing charge organization are specialized and not readily available for routine measurements. This represents a significant roadblock in elucidating these correlations. We use a combination of transmission and polarized-ATR infrared spectroscopy to measure the degree of charge organization for ionic liquids. The technique is illustrated with a family of 1-alkyl-3-methylimidazolium trifluoromethansulfonate ionic liquids at 30°C. As expected, the amount of charge organization decreases as the alkyl side chain is lengthened, highlighting the important role of short-range repulsive interactions in defining quasilattice structure. Inherent limitations of the method are identified and discussed. The quantitative measurements of charge organization are then correlated with trends in the transport properties of the compounds to highlight the relationship between charge and momentum transport and the underlying liquid structure. Most research laboratories possess infrared spectrometers capable of conducting these measurements, thus, the proposed method may represent a cost-effective solution for routinely measuring charge organization in ionic liquids. PMID:23781877

  8. Infrared spectra of organic liquids and cluster model of substance

    NASA Astrophysics Data System (ADS)

    Verveyko, Vyacheslav N.; Verveyko, Marina V.; Melnikov, Gennady A.

    2016-03-01

    We consider the effective field theory based on the consideration of the rotation and libration of molecules in surroundings represented as effective clusters. The suitable distribution function with respect to the number of particles, which form a cluster, is discussed. This approach is applied to the forecasting of infrared spectrum frequencies of liquids using liquefied inert gases, nitrogen, oxygen, benzene and water as examples.

  9. Modeling the gas-particle partitioning of secondary organic aerosol: the importance of liquid-liquid phase separation

    NASA Astrophysics Data System (ADS)

    Zuend, A.; Seinfeld, J. H.

    2012-01-01

    The partitioning of semivolatile organic compounds between the gas phase and aerosol particles is an important source of secondary organic aerosol (SOA). Gas-particle partitioning of organic and inorganic species is influenced by the physical state and water content of aerosols, and therefore ambient relative humidity (RH), as well as temperature and organic loading levels. We introduce a novel combination of the thermodynamic models AIOMFAC (for liquid mixture non-ideality) and EVAPORATION (for pure compound vapor pressures) with oxidation product information from the Master Chemical Mechanism (MCM) for the computation of gas-particle partitioning of organic compounds and water. The presence and impact of a liquid-liquid phase separation in the condensed phase is calculated as a function of variations in relative humidity, organic loading levels, and associated changes in aerosol composition. We show that a complex system of water, ammonium sulfate, and SOA from the ozonolysis of α-pinene exhibits liquid-liquid phase separation over a wide range of relative humidities (simulated from 30% to 99% RH). Since fully coupled phase separation and gas-particle partitioning calculations are computationally expensive, different simplified model approaches are tested with regards to computational costs and accuracy of predictions compared to the benchmark calculation. Both forcing a liquid one-phase aerosol considering non-ideal mixing or assuming an ideal mixture bear the potential for vastly incorrect partitioning predictions. Assuming an ideal mixture leads to substantial overestimation of the particulate organic mass, at high RH by more than 200%. Moreover, the simplified one-phase cases stress two key points for accurate gas-particle partitioning calculations: (1) non-ideality in the condensed phase needs to be considered and (2) liquid-liquid phase separation is a consequence of considerable deviations from ideal mixing in solutions containing inorganic ions and

  10. Modeling the gas-particle partitioning of secondary organic aerosol: the importance of liquid-liquid phase separation

    NASA Astrophysics Data System (ADS)

    Zuend, A.; Seinfeld, J. H.

    2012-05-01

    The partitioning of semivolatile organic compounds between the gas phase and aerosol particles is an important source of secondary organic aerosol (SOA). Gas-particle partitioning of organic and inorganic species is influenced by the physical state and water content of aerosols, and therefore ambient relative humidity (RH), as well as temperature and organic loading levels. We introduce a novel combination of the thermodynamic models AIOMFAC (for liquid mixture non-ideality) and EVAPORATION (for pure compound vapor pressures) with oxidation product information from the Master Chemical Mechanism (MCM) for the computation of gas-particle partitioning of organic compounds and water. The presence and impact of a liquid-liquid phase separation in the condensed phase is calculated as a function of variations in relative humidity, organic loading levels, and associated changes in aerosol composition. We show that a complex system of water, ammonium sulfate, and SOA from the ozonolysis of α-pinene exhibits liquid-liquid phase separation over a wide range of relative humidities (simulated from 30% to 99% RH). Since fully coupled phase separation and gas-particle partitioning calculations are computationally expensive, several simplified model approaches are tested with regard to computational costs and accuracy of predictions compared to the benchmark calculation. It is shown that forcing a liquid one-phase aerosol with or without consideration of non-ideal mixing bears the potential for vastly incorrect partitioning predictions. Assuming an ideal mixture leads to substantial overestimation of the particulate organic mass, by more than 100% at RH values of 80% and by more than 200% at RH values of 95%. Moreover, the simplified one-phase cases stress two key points for accurate gas-particle partitioning calculations: (1) non-ideality in the condensed phase needs to be considered and (2) liquid-liquid phase separation is a consequence of considerable deviations from ideal

  11. Chemical reactions of metal powders with organic and inorganic liquids during ball milling

    NASA Technical Reports Server (NTRS)

    Arias, A.

    1975-01-01

    Chromium and/or nickel powders were milled in metal chlorides and in organic liquids representative of various functional groups. The powders always reacted with the liquid and became contaminated with elements from them. The milled powders had specific surface areas ranging from 0.14 to 37 sq m/g, and the total contamination with elements from the milling liquid ranged from 0.01 to 56 weight percent. Compounds resulting from substitution, addition, or elimination reactions formed in or from the milling liquid.

  12. Reverse osmosis molecular differentiation of organic liquids using carbon molecular sieve membranes.

    PubMed

    Koh, Dong-Yeun; McCool, Benjamin A; Deckman, Harry W; Lively, Ryan P

    2016-08-19

    Liquid-phase separations of similarly sized organic molecules using membranes is a major challenge for energy-intensive industrial separation processes. We created free-standing carbon molecular sieve membranes that translate the advantages of reverse osmosis for aqueous separations to the separation of organic liquids. Polymer precursors were cross-linked with a one-pot technique that protected the porous morphology of the membranes from thermally induced structural rearrangement during carbonization. Permeation studies using benzene derivatives whose kinetic diameters differ by less than an angstrom show kinetically selective organic liquid reverse osmosis. Ratios of single-component fluxes for para- and ortho-xylene exceeding 25 were observed and para- and ortho- liquid mixtures were efficiently separated, with an equimolar feed enriched to 81 mole % para-xylene, without phase change and at ambient temperature. PMID:27540170

  13. Method for monitoring the crystallization of an organic material from a liquid

    DOEpatents

    Asay, Blaine W.; Henson, Bryan F.; Sander, Robert K.; Robinson, Jeanne M.; Son, Steven F.; Dickson, Peter M.

    2004-10-05

    Method for monitoring the crystallization of at least one organic material from a liquid. According to the method, a liquid having at least one organic material capable of existing in at least one non-centrosymmetric phase is prepared. The liquid is interrogated with a laser beam at a chosen wavelength. As at least a portion of the at least one organic material crystallizes from the liquid, the intensity of any light scattered by the crystallized material at a wavelength equal to one-half the chosen wavelength of the interrogating laser beam is monitored. If the intensity of this scattered light, increases, then the crystals that form include at least one non-cetrosymmetric phase.

  14. Measurement and Estimation of Organic-Liquid/Water Interfacial Areas for Several Natural Porous Media

    SciTech Connect

    Brusseau, M.L.; Narter, M.; Schnaar, G.; Marble, J.

    2009-06-01

    The objective of this study was to quantitatively characterize the impact of porous-medium texture on interfacial area between immiscible organic liquid and water residing within natural porous media. Synchrotron X-ray microtomography was used to obtain high-resolution, three-dimensional images of solid and liquid phases in packed columns. The image data were processed to generate quantitative measurements of organic-liquid/water interfacial area and of organic-liquid blob sizes. Ten porous media, comprising a range of median grain sizes, grain-size distributions, and geochemical properties, were used to evaluate the impact of porous-medium texture on interfacial area. The results show that fluid-normalized specific interfacial area (A{sub f}) and maximum specific interfacial area (A{sub m}) correlate very well to inverse median grain diameter. These functionalities were shown to result from a linear relationship between effective organic-liquid blob diameter and median grain diameter. These results provide the basis for a simple method for estimating specific organic-liquid/water interfacial area as a function of fluid saturation for a given porous medium. The availability of a method for which the only parameter needed is the simple-to-measure median grain diameter should be of great utility for a variety of applications.

  15. Fluorescence decay-time constants in organic liquid scintillators

    SciTech Connect

    Marrodan Undagoitia, T.; Feilitzsch, F. von; Oberauer, L.; Potzel, W.; Ulrich, A.; Winter, J.; Wurm, M.

    2009-04-15

    The fluorescence decay-time constants have been measured for several scintillator mixtures based on phenyl-o-xylylethane (PXE) and linear alkylbenzene (LAB) solvents. The resulting values are of relevance for the physics performance of the proposed large-volume liquid scintillator detector Low Energy Neutrino Astronomy (LENA). In particular, the impact of the measured values to the search for proton decay via p{yields}K{sup +}{nu} is evaluated in this work.

  16. THERMODYNAMIC MODELING OF LIQUID AEROSOLS CONTAINING DISSOLVED ORGANICS AND ELECTROLYTES

    EPA Science Inventory

    Many tropospheric aerosols contain large fractions of soluble organic material, believed to derive from the oxidation of precursors such alpha-pinene. The chemical composition of aerosol organic matter is complex and not yet fully understood.

    The key properties of solu...

  17. Vacuum Surface Science Meets Heterogeneous Catalysis: Dehydrogenation of a Liquid Organic Hydrogen Carrier in the Liquid State.

    PubMed

    Matsuda, Takashi; Taccardi, Nicola; Schwegler, Johannes; Wasserscheid, Peter; Steinrück, Hans-Peter; Maier, Florian

    2015-06-22

    Ultrahigh vacuum (UHV) surface science techniques are used to study the heterogeneous catalytic dehydrogenation of a liquid organic hydrogen carrier in its liquid state close to the conditions of real catalysis. For this purpose, perhydrocarbazole (PH), otherwise volatile under UHV, is covalently linked as functional group to an imidazolium cation, forming a non-volatile ionic liquid (IL). The catalysed dehydrogenation of the PH unit as a function of temperature is investigated for a Pt foil covered by a macroscopically thick PH-IL film and for Pd particles suspended in the PH-IL film, and for PH-IL on Au as inert support. X-ray photoelectron spectroscopy and thermal desorption spectroscopy allows us to follow in situ the catalysed transition of perhydrocarbazole to carbazole at technical reaction temperatures. The data demonstrate the crucial role of the Pt and Pd catalysts in order to shift the dehydrogenation temperature below the critical temperature of thermal decomposition. PMID:25891821

  18. Development of dispersive liquid-liquid microextraction based on solidification of floating organic drop for the determination of trace nickel.

    PubMed

    Wang, Yukun; Zhang, Jingwen; Zhao, Bin; Du, Xin; Ma, Jingjun; Li, Jingci

    2011-12-01

    A liquid-phase microextraction technique was developed using dispersive liquid-liquid microextraction based on solidification of floating organic drop combined with flame atomic absorption spectrometry, for the extraction and determination of trace amounts of nickel in water samples. Microextraction efficiency factors, such as the type and volume of extraction and dispersive solvents, pH, extraction time, the chelating agent amount, and ionic strength, were investigated and optimized. Under optimum conditions, the calibration graph was linear in the range of 4.23-250 μg L(-1) with a detection limit of 1.27 μg L(-1). The relative standard deviation for ten replicate measurements of 10 and 100 μg L(-1) of nickel were 3.21% and 2.55%, respectively. The proposed method was assessed through the analysis of certified reference water or recovery experiments. PMID:21598026

  19. Estimation of Interfacial Tension between Organic Liquid Mixtures and Water

    SciTech Connect

    Yoon, Hongkyu; Oostrom, Martinus; Werth, Charles J.

    2009-10-15

    Knowledge of IFT values for chemical mixtures helps guide the design and analysis of various processes, including NAPL remediation with surfactants or alcohol flushing, enhanced oil recovery, and chemical separation technologies, yet available literature values are sparse. A comprehensive comparison of thermodynamic and empirical models for estimating interfacial tension (IFT) of organic chemical mixtures with water is conducted, mainly focusing on chlorinated organic compounds for 14 ternary, three quaternary, and one quinary systems. Emphasis is placed on novel results for systems with three and four organic chemical compounds, and for systems with composite organic compounds like lard oil and mineral oil. Seven models are evaluated: the ideal and nonideal monolayer models (MLID and MLNID), the ideal and nonideal mutual solubility models (MSID and MSNID), an empirical model for ternary systems (EM), a linear mixing model based on mole fractions (LMMM), and a newly developed linear mixing model based on volume fractions of organic mixtures (LMMV) for higher order systems. The two ideal models (MLID and MSID) fit ternary systems of chlorinated organic compounds without surface active compounds relatively well. However, both ideal models did not perform well for the mixtures containing a surface active compound. However, for these systems, both the MLNID and MSNID models matched the IFT data well. It is shown that the MLNID model with a surface coverage value (0.00341 mmol/m2) obtained in this study can practically be used for chlorinated organic compounds. The LMMM results in poorer estimates of the IFT as the difference in IFT values of individual organic compounds in a mixture increases. The EM, with two fitting parameters, provided accurate results for all 14 ternary systems including composite organic compounds. The new LMMV method for quaternary and higher component systems was successfully tested. This study shows that the LMMV may be able to be used for

  20. Shear-Triggered Crystallization and Light Emission of a Thermally Stable Organic Supercooled Liquid.

    PubMed

    Chung, Kyeongwoon; Kwon, Min Sang; Leung, Brendan M; Wong-Foy, Antek G; Kim, Min Su; Kim, Jeongyong; Takayama, Shuichi; Gierschner, Johannes; Matzger, Adam J; Kim, Jinsang

    2015-05-27

    Thermodynamics drive crystalline organic molecules to be crystallized at temperatures below their melting point. Even though molecules can form supercooled liquids by rapid cooling, crystalline organic materials readily undergo a phase transformation to an energetically favorable crystalline phase upon subsequent heat treatment. Opposite to this general observation, here, we report molecular design of thermally stable supercooled liquid of diketopyrrolopyrrole (DPP) derivatives and their intriguing shear-triggered crystallization with dramatic optical property changes. Molten DPP8, one of the DPP derivatives, remains as stable supercooled liquid without crystallization through subsequent thermal cycles. More interestingly, under shear conditions, this supercooled liquid DPP8 transforms to its crystal phase accompanied by a 25-fold increase in photoluminescence (PL) quantum efficiency and a color change. By systematic investigation on supercooled liquid formation of crystalline DPP derivatives and their correlation with chemical structures, we reveal that the origin of this thermally stable supercooled liquid is a subtle force balance between aromatic interactions among the core units and van der Waals interactions among the aliphatic side chains acting in opposite directions. Moreover, by applying shear force to a supercooled liquid DPP8 film at different temperatures, we demonstrated direct writing of fluorescent patterns and propagating fluorescence amplification, respectively. Shear-triggered crystallization of DPP8 is further achieved even by living cell attachment and spreading, demonstrating the high sensitivity of the shear-triggered crystallization which is about 6 orders of magnitude more sensitive than typical mechanochromism observed in organic materials. PMID:27162955

  1. Shear-Triggered Crystallization and Light Emission of a Thermally Stable Organic Supercooled Liquid

    PubMed Central

    2015-01-01

    Thermodynamics drive crystalline organic molecules to be crystallized at temperatures below their melting point. Even though molecules can form supercooled liquids by rapid cooling, crystalline organic materials readily undergo a phase transformation to an energetically favorable crystalline phase upon subsequent heat treatment. Opposite to this general observation, here, we report molecular design of thermally stable supercooled liquid of diketopyrrolopyrrole (DPP) derivatives and their intriguing shear-triggered crystallization with dramatic optical property changes. Molten DPP8, one of the DPP derivatives, remains as stable supercooled liquid without crystallization through subsequent thermal cycles. More interestingly, under shear conditions, this supercooled liquid DPP8 transforms to its crystal phase accompanied by a 25-fold increase in photoluminescence (PL) quantum efficiency and a color change. By systematic investigation on supercooled liquid formation of crystalline DPP derivatives and their correlation with chemical structures, we reveal that the origin of this thermally stable supercooled liquid is a subtle force balance between aromatic interactions among the core units and van der Waals interactions among the aliphatic side chains acting in opposite directions. Moreover, by applying shear force to a supercooled liquid DPP8 film at different temperatures, we demonstrated direct writing of fluorescent patterns and propagating fluorescence amplification, respectively. Shear-triggered crystallization of DPP8 is further achieved even by living cell attachment and spreading, demonstrating the high sensitivity of the shear-triggered crystallization which is about 6 orders of magnitude more sensitive than typical mechanochromism observed in organic materials. PMID:27162955

  2. Sorption of vapors of some organic liquids on soil humic acid and its relation to partitioning of organic compounds in soil organic matter

    USGS Publications Warehouse

    Chlou, G.T.; Kile, D.E.; Malcolm, R.L.

    1988-01-01

    Vapor sorption of water, ethanol, benzene, hexane, carbon tetrachloride, 1,1,1-trichloroethane, trichloroethylene, tetrachloroethylene, and 1,2-dibromoethane on (Sanhedron) soil humic acid has been determined at room temperature. Isotherms for all organic liquids are highly linear over a wide range of relative pressure (P/P??), characteristic of the partitioning (dissolution) of the organic compounds in soil humic acid. Polar liquids exhibit markedly greater sorption capacities on soil humic acid than relatively nonpolar liquids, in keeping with the polar nature of the soil humic acid as a partition medium. The limiting sorption (partition) capacities of relatively non-polar liquids are remarkably similar when expressed in terms of volumes per unit weight of soil humic acid. The soil humic acid is found to be about half as effective as soil organic matter in sorption of relatively nonpolar organic compounds. The nearly constant limiting sorption capacity for nonpolar organic liquids with soil humic acid on a volume-to-weight basis and its efficiency in sorption relative to soil organic matter provide a basis for predicting the approximate sorption (partition) coefficients of similar compounds in uptake by soil in aqueous systems.

  3. Compressed and saturated liquid densities for 18 halogenated organic compounds

    SciTech Connect

    Defibaugh, D.R.; Moldover, M.R.

    1997-01-01

    The pressure-density-temperature P({rho},T) behavior of 18 liquids that are potential working fluids in thermal machinery has been measured using a vibrating tube densimeter. For each liquid, the data were taken on isotherms spaced at intervals of 5 K to 10 K spanning the temperature range 245 K to 370 K. The pressures ranged from just above the vapor pressure (or the critical pressure) to 6500 kPa. The results of measurements at more than 12,000 thermodynamic points are summarized by correlating functions. Comparison with data from other laboratories indicates that the relative expanded uncertainty in the measured densities is less than 0.05%, except in the critical region. The repeatability of the vapor pressure to obtain the density of the liquid at the vapor pressure. The fluids studied (and their designations by the refrigeration industry) were trichlorofluoromethane (R11), chlorodifluoromethane (R22), 1,1-dichloro-2,2,2-trifluoroethane (R123), 1,2-dichloro-1,2,2-trifluoroethane (R123a), 1-chloro-1,2,2,2-tetrafluoroethane (R124), 1,1,2,2-tetrafluoroethane (R134), 1,1,1,2-tetrafluoroethane (R134a), 1,1-dichloro-1-fluoroethane (R141b), 1,1,1-trifluoroethane (R143), 1,1,2-trifluoroethane (R143a), pentafluorodimethyl ether (E125), 1,1-difluoroethane (R152a), octafluoropropane (R218), 1,1,1,2,3,3,3-heptafluoropropane (R227ea), 2-(difluoromethoxy)-1,1,1-trifluoroethane (E245), 1,1,1,2,2-pentafluoropropane (R245cb), 1,1,1,3,3-pentafluoropropane (R245fa), and propane (R290).

  4. Underwater Spontaneous Pumpless Transportation of Nonpolar Organic Liquids on Extreme Wettability Patterns.

    PubMed

    Huang, Shuai; Song, Jinlong; Lu, Yao; Chen, Faze; Zheng, Huanxi; Yang, Xiaolong; Liu, Xin; Sun, Jing; Carmalt, Claire J; Parkin, Ivan P; Xu, Wenji

    2016-02-10

    Spontaneous pumpless transportation (SPT) of liquids has generated tremendous demands in microfluidic systems and advanced devices. However, the transportation of nonpolar organic liquids on open platforms underwater remains a challenge because most existing SPT systems are only designed for use in air. Here, we report a surface-tension-driven SPT system to transport various nonpolar organic liquids using underwater extreme wettability patterns. The patterns were fabricated with a wedge-shaped superoleophilic track on a superoleophobic background by combining CuCl2 etching, stearic acid modification, and mask-based nitrogen cold plasma treatment. Three types of underwater SPT processes-horizontal transport, tilted transport, and directional transport-were studied experimentally and theoretically. For horizontal SPT and tilted SPT, the capillary force was the main driving force, which depended on the wedge angle of the superoleophilic track. The excellent transportation ability of horizontal SPT of underwater liquid droplets was obtained at a wedge angle of 3-5°. The maximum moving height of organic liquids on the tilted SPT transport was obtained at an angle of 8°. For directional SPT, organic liquids did not drop off in the moving process because of the constraint imposed by surface tension, resulting in the sustained directional transport with long distances and complex trajectories. PMID:26785602

  5. High liquid yield process for retorting various organic materials including oil shale

    DOEpatents

    Coburn, Thomas T.

    1990-01-01

    This invention is a continuous retorting process for various high molecular weight organic materials, including oil shale, that yields an enhanced output of liquid product. The organic material, mineral matter, and an acidic catalyst, that appreciably adsorbs alkenes on surface sites at prescribed temperatures, are mixed and introduced into a pyrolyzer. A circulating stream of olefin enriched pyrolysis gas is continuously swept through the organic material and catalyst, whereupon, as the result of pyrolysis, the enhanced liquid product output is provided. Mixed spent organic material, mineral matter, and cool catalyst are continuously withdrawn from the pyrolyzer. Combustion of the spent organic material and mineral matter serves to reheat the catalyst. Olefin depleted pyrolysis gas, from the pyrolyzer, is enriched in olefins and recycled into the pyrolyzer. The reheated acidic catalyst is separated from the mineral matter and again mixed with fresh organic material, to maintain the continuously cyclic process.

  6. A high liquid yield process for retorting various organic materials including oil shale

    DOEpatents

    Coburn, T.T.

    1988-07-26

    This invention is a continuous retorting process for various high molecular weight organic materials, including oil shale, that yields an enhanced output of liquid product. The organic material, mineral matter, and an acidic catalyst, that appreciably adsorbs alkenes on surface sites at prescribed temperatures, are mixed and introduced into a pyrolyzer. A circulating stream of olefin enriched pyrolysis gas is continuously swept through the organic material and catalyst, whereupon, as the result of pyrolysis, the enhanced liquid product output is provided. Mixed spent organic material, mineral matter, and cool catalyst are continuously withdrawn from the pyrolyzer. Combustion of the spent organic material and mineral matter serves to reheat the catalyst. Olefin depleted pyrolysis gas, from the pyrolyzer, is enriched in olefins and recycled into the pyrolyzer. The reheated acidic catalyst is separated from the mineral matter and again mixed with fresh organic material, to maintain the continuously cyclic process. 2 figs.

  7. Analysis of a gas-liquid film plasma reactor for organic compound oxidation.

    PubMed

    Hsieh, Kevin; Wang, Huijuan; Locke, Bruce R

    2016-11-01

    A pulsed electrical discharge plasma formed in a tubular reactor with flowing argon carrier gas and a liquid water film was analyzed using methylene blue as a liquid phase hydroxyl radical scavenger and simultaneous measurements of hydrogen peroxide formation. The effects of liquid flow rate, liquid conductivity, concentration of dye, and the addition of ferrous ion on dye decoloration and degradation were determined. Higher liquid flow rates and concentrations of dye resulted in less decoloration percentages and hydrogen peroxide formation due to initial liquid conductivity effects and lower residence times in the reactor. The highest decoloration energy yield of dye found in these studies was 5.2g/kWh when using the higher liquid flow rate and adding the catalyst. The non-homogeneous nature of the plasma discharge favors the production of hydrogen peroxide in the plasma-liquid interface over the chemical oxidation of the organic in the bulk liquid phase and post-plasma reactions with the Fenton catalyst lead to complete utilization of the plasma-formed hydrogen peroxide. PMID:27267693

  8. LABORATORY INVESTIGATION OF RESIDUAL LIQUID ORGANICS FROM SPILLS, LEAKS, AND THE DISPOSAL OF HAZARDOUS WASTES IN GROUNDWATER

    EPA Science Inventory

    Organic liquids that are essentially immiscible with water migrate through the subsurface under the influence of capillary, viscous, and buoyancy forces. These liquids originate from the improper disposal of hazardous wastes, and the spills and leaks of petroleum hydrocarbons a...

  9. Liquid drop technique for generation of organic glass and metal shells

    NASA Technical Reports Server (NTRS)

    Hendricks, C. D.

    1982-01-01

    It was found that liquid drop techniques are very useful in several diverse areas. For producing very uniform metallic, organic, inorganic and, on particular, glassy shells, the liquid jet method is the most reproducible and exceptionally useful of all the techniques studied. The technique of capillary wave synchronization of the break-up of single and multiple component jets was utilized to produce uniform sized liquid drops and solid particles, and hollow liquid and solid shells. The technique was also used to encapsulate a number of liquids in impermeable spherical shells. Highly uniform glass shells were made by generating uniform drops of glass forming materials in an aqueous solution, subsequently evaporating the water, and then fusing and blowing the remaining solids in a high temperature vertical tube furnace. Experimental results are presented and the critical problems in further research in this field are discussed.

  10. Removal of non-ionic organic pollutants from water via liquid-liquid extraction.

    PubMed

    López-Montilla, Juan C; Pandey, Samir; Shah, Dinesh O; Crisalle, Oscar D

    2005-05-01

    The removal of model pollutants bromocresol green (BG) and phenol from water is demonstrated via two liquid-liquid extraction methods. Both methods exploit selective interactions established by the pollutant molecule with a surfactant, oil, or alcohol, and are variants of the more general Winsor systems where the phases are in contact along an extremely large interfacial area. In the first method the surfactant and the co-surfactant move from a predominantly oil-in-water microemulsion (Winsor I), to a middle phase microemulsion (Winsor III), and finally to a water-in-oil microemulsion (Winsor II), as the physicochemical conditions of salinity, temperature or hydrophilic-lipophilic balance of the surfactant system are varied. This method achieves better than 99% removal of the pollutant BG from water. It is argued that the removal is produced upon increasing the salinity of the system because the interaction of BG with a medium chain-length alcohol drives it to move along with the alcohol to another phase. The second method, which is scalable to industrial levels, uses a spontaneously produced water-in-oil microemulsion with large interfacial area that appears after bringing in contact water and a pre-formed Winsor II or Winsor III microemulsion system containing different surfactants and oils. The method is applied to the removal of phenol from water, and it is found that systems with polar oils such as ethyl butyrate or with cationic surfactants such as stearyl trimethylammonium chloride are more efficient in removing phenol than systems with normal alkanes or anionic surfactants. It is also shown that a microemulsion formed using a polar oil performs better than using only the polar oil as the extraction solvent. Finally, the efficiency of the second liquid-liquid extraction method can be increased from 69% in a single-stage process to 83% in a two-stage process, using the same total amount of extraction solvent. PMID:15899289

  11. Microbial consortium role in processing liquid waste of vegetables in Keputran Market Surabaya as organic liquid fertilizer ferti-plus

    NASA Astrophysics Data System (ADS)

    Rizqi, Fauziah; Supriyanto, Agus; Lestari, Intan; Lita Indri D., L.; Elmi Irmayanti, A.; Rahmaniyah, Fadilatur

    2016-03-01

    Many activities in this market is directly proportional to increase production of vegetables waste, especially surabaya. Therefore, in this study aims to utilize liquid waste of vegetables into liquid organic fertilizer by mixing microbial consorsium. The microbial consorsium consist of Azotobacter chrococcum, Azospirillum brasilense, Rhizobium leguminosarum, Bacillus subtilis, Bacillus megaterium, Pseudomonas putida, and Pseudomonas fluorescens. Ttreatment of microbial concentrations (5%, 10%, 15%) and the length of the incubation period (7 days, 14 days, 21 days) used in this research. The parameters used are: C/N ratio, levels of CNP, and BOD value. This study uses a standard organic fertilizer value according SNI19-7030-2004, The results show the value of C/N ratio comply with the ISO standards. C levels showed an increase during the incubation period but not compare with standards. N levels that compare with standards are microbial treatment in all group concentration except control group with an incubation period of 21 days is > 7. P levels compare with the existing standards in the group of microbe concentration of 10% and 15% during the incubation period. The value of the initial BOD liquid waste of vegetable is 790.25 mg / L, this value indicates that the waste should not go into the water body. Accordingly, the results of this study can not be used as a liquid organic fertilizer, but potentially if it is used as a natural career or build natural soil. The Building natural soil is defined as the natural ingredients that can be used to improve soil properties.

  12. Membrane permeation process for dehydration of organic liquid mixtures using sulfonated ion-exchange polyalkene membranes

    DOEpatents

    Cabasso, Israel; Korngold, Emmanuel

    1988-01-01

    A membrane permeation process for dehydrating a mixture of organic liquids, such as alcohols or close boiling, heat sensitive mixtures. The process comprises causing a component of the mixture to selectively sorb into one side of sulfonated ion-exchange polyalkene (e.g., polyethylene) membranes and selectively diffuse or flow therethrough, and then desorbing the component into a gas or liquid phase on the other side of the membranes.

  13. Direct Capture of Organic Acids From Fermentation Media Using Ionic Liquids

    SciTech Connect

    Klasson, K.T.

    2004-11-03

    Several ionic liquids have been investigated for the extraction of organic acids from fermentation broth. Partitioning of representative organic acids (lactic, acetic, and succinic) between aqueous solution and nine hydrophobic ionic liquids was measured. The extraction efficiencies were strongly dependent on pH of the aqueous phase. Distribution coefficient was very good (approximately 60) at low succinic acid concentrations for one of the ionic liquids (trihexyltetradecylphosphonium methanesulfonate) at neutral pH. However, this ionic liquid had to be diluted with nonanol due to its high viscosity in order to be useful. A diluent (trioctylamine) was also added to this mixture. The results suggest that an extraction system based on ionic liquids may be feasible for succinic acid recovery from fermentation broth and that two ideal extraction stages are needed to reduce the concentration from 33 g/L to 1 g/L of succinic acid. Further studies are needed to evaluate other issues related to practical applications, including ionic liquid loss in the process, toxicity effects of ionic liquids during simultaneous fermentation and extractions.

  14. Liquid organic foams for formulation optimization : an assessment of foam linear viscoelasticity and its temporal dependence.

    SciTech Connect

    Kropka, Jamie Michael; Celina, Mathias Christopher; Mondy, Lisa Ann

    2010-03-01

    Liquid foams are viscoelastic liquids, exhibiting a fast relaxation attributed to local bubble motions and a slow response due to structural evolution of the intrinsically unstable system. In this work, these processes are examined in unique organic foams that differ from the typically investigated aqueous systems in two major ways: the organic foams (1) posses a much higher continuous phase viscosity and (2) exhibit a coarsening response that involves coalescence of cells. The transient and dynamic relaxation responses of the organic foams are evaluated and discussed in relation to the response of aqueous foams. The change in the foam response with increasing gas fraction, from that of a Newtonian liquid to one that is strongly viscoelastic, is also presented. In addition, the temporal dependencies of the linear viscoelastic response are assessed in the context of the foam structural evolution. These foams and characterization techniques provide a basis for testing stabilization mechanisms in epoxy-based foams for encapsulation applications.

  15. Structural organization of liquid crystals at liquid crystal-air interface: Synchrotron X-ray reflectivity and computational simulations

    NASA Astrophysics Data System (ADS)

    Sadati, Monirosadat; Ramezani-Dakhel, Hadi; Bu, Wei; Sevgen, Emre; Liang, Zhu; Erol, Cem; Taheri Qazvini, Nader; Rahimi, Mohammad; Lin, Binhua; Roux, Benoit; Schlossman, Mark; de Pablo, Juan J.

    Numerous applications of liquid crystals (LC) rely on control of molecular orientation at an interface. However, little is known about the precise molecular structure of such interfaces. In this work, we have performed synchrotron X-ray reflectivity measurements accompanied by an advanced theoretical and computational analysis to study the structural organization of liquid crystals at the air-liquid crystal interface. The X-ray reflectivity was measured from two nematic (5CB) and smectic (8CB) liquid crystals at several temperatures, in the nematic phase and above the nematic-isotropic transition. Our computational simulations and X-ray reflectivity results indicate that in the case of 8CB nematic phase, incipient bulk smectic fluctuations are pinned at the interface to form temperature-dependent multilayers at the interface. Such layers can extend far from the interface. However, the interface of 5CB in the nematic phase exhibits a relatively small number of layers. These measurements will be extended to the study of the LC-aqueous electrolyte interfaces to understand the effects of electrostatic interactions and external stimuli on the interfacial anchoring energy and LC orientational ordering.

  16. Methods for calculation of engineering parameters for gas separation. [vapor pressure and solubility of gases in organic liquids

    NASA Technical Reports Server (NTRS)

    Lawson, D. D.

    1979-01-01

    A group additivity method is generated which allows estimation, from the structural formulas alone, of the energy of vaporization and the molar volume at 25 C of many nonpolar organic liquids. Using these two parameters and appropriate thermodynamic relations, the vapor pressure of the liquid phase and the solubility of various gases in nonpolar organic liquids are predicted. It is also possible to use the data to evaluate organic and some inorganic liquids for use in gas separation stages or liquids as heat exchange fluids in prospective thermochemical cycles for hydrogen production.

  17. Ultrasonic imaging of organic liquid contaminants in unconsolidated porous media

    NASA Astrophysics Data System (ADS)

    Geller, Jil T.; Myer, Larry R.

    1995-08-01

    Laboratory experiments were conducted to measure the change in the ultrasonic wave signature as a function of the fraction of nonaqueous-phase liquid (NAPL) contaminants in initially water-saturated sand samples. This represents a fundamental step in the application of high-frequency seismic measurements to detect and delineate NAPL contamination in groundwater. The NAPL's used are n-dodecane, iso-octane and Freon 113®. P-wave velocity changes almost linearly as a function of the fraction of pore space occupied by NAPL. At a given NAPL fraction, the velocities rank with the bulk moduli of the NAPL's. The percent change in velocity at residual water saturation relative to the water-saturated medium ranges from 15% for n-dodecane to 31% for Freon 113®. Velocity changes are significant relative to the ability of seismic methods to detect changes on the order of 5%. These data are described by a model previously derived by G.T. Kuster and M.N. Toksöz of P-wave transmission through a fluid matrix with spherical inclusions that is modified to account for a two-fluid-phase matrix. Amplitude data as a function of NAPL fraction are described by assuming the distribution of NAPL in the column and using attenuation coefficients for the water-saturated and residual-water medium. Amplitudes are shown to be sensitive to both the fraction of NAPL and its distribution, whereas velocity is only a function of NAPL fraction.

  18. Enhanced mineralization of organic compounds in nonaqueous-phase liquids

    SciTech Connect

    Labare, M.P.; Alexander, M.

    1995-11-01

    Biodegradation of phenanthrene, biphenyl, or di(2-ethylhexyl) phthalate initially present in a variety of nonaqueous-phase liquids (NAPLs) was slow in samples of soil and aquifer solids. The NAPLs were hexadecane, dibutyl phthalate, 2, 2, 4 ,4, 6, 8, 8-heptamethylnonane, cyclohexane, commercial oils, crude oil, creosote, and kerosene. Slurrying the soil or aquifer solids markedly enhanced the rate and extent of mineralization of the test compounds initially in many of the NAPLs. Both the low rate and extent of mineralization of the three compounds initially in dibutyl phthalate in soil slurries and of di(2- ethylhexyl) phthalate in heptamethylnonane present in slurries of aquifer solids were increased by inoculation of acclimated microbial cultures. Increasing the NAPL volume decreased phenanthrene biodegradation in soil, but the effect of larger NAPL volume could be alleviated by slurrying and inoculation. The rate or extent of mineralization in aquifer slurries of di(2-ethylhexyi) phthalate initially in some NAPLs was increased by addition of N and P, and inoculation further enhanced the degradation.

  19. Remotely operated organic liquid waste incinerator for the fuels and materials examination facility

    SciTech Connect

    Sales, W.L.; Barker, R.E.; Hershey, R.B.

    1980-01-01

    The search for a practical method for the disposal of small quantities of oraganic liquid waste, a waste product of metallographic sample preparation at the Fuels and Materials Examination Facility has led to the design of an incinerator/off-gas system to burn organic liquid wastes and selected organic solids. The incinerator is to be installed in a shielded inert-atmosphere cell, and will be remotely operated and maintained. The off-gas system is a wet-scrubber and filter system designed to release particulate-free off-gas to the FMEF Building Exhaust System.

  20. Graphene oxide membrane for liquid phase organic molecular separation

    NASA Astrophysics Data System (ADS)

    Liu, Renlong; Arabale, Girish; Kim, Jinseon; Sun, Ke; Lee, Yongwoon; Ryu, Changkook; Lee, Changgu

    2015-03-01

    The selective permeation of organic solvents and water through graphene oxide (GO) membranes has been demonstrated. Water was found to permeate through GO membranes faster than various alcohols. The permeation rates of propanol are about 80 times lower than that of water. Taking advantage of the differences in the permeation rates, we separated water from the alcohols and obtained alcohols with high purity. For ethanol and 1-propanol, binary solutions of the alcohol and water were filtered efficiently to produce alcohols with concentration of about 97%. However, the selectivity of the filtration of methanol is significantly lower than those of the other alcohols. To understand the mechanism we followed the structural changes in the GO membranes by X-Ray diffraction analysis. From the X-ray diffraction results we speculate that the selectivity of the permeation of water and alcohols is closely related to the molecular sizes of the solvents and their polarity. In order to demonstrate the potential applications of this process for the selective removal of water from aqueous organic mixtures, we performed the separation of water from a bio-oil containing 73% of water. The majority of the water was filtered out resulting in a higher purity bio-oil.

  1. NONIDEAL BEHAVIOR DURING COMPLETE DISSOLUTION OF ORGANIC IMMISCIBLE LIQUID IN NATURAL POROUS MEDIA

    PubMed Central

    Russo, A.E.; Mahal, M.K.; Brusseau, M.L.

    2011-01-01

    Experiments were conducted to investigate the complete dissolution of organic immiscible liquid residing within natural porous media. Organic-liquid dissolution was investigated by conducting experiments with homogeneously packed columns containing a residual saturation of organic liquid (trichloroethene). The porous media used comprised different textures (ranges of particle-size distributions) and organic-carbon contents. The dissolution behavior that was observed for the soil and aquifer sediment systems deviated from the behavior typically observed for systems composed of ideal sands. Specifically, multi-step elution curves were observed, with multiple extended periods of relatively constant contaminant flux. This behavior was more pronounced for the two media with larger particle-size distributions. Conversely, this type of dissolution behavior was not observed for the control system, which consisted of a well-sorted sand. It is hypothesized that the pore-scale configuration of the organic liquid and of the flow field is more complex for the poorly sorted media, and that this greater complexity constrains dissolution dynamics, leading to the observed nonideal behavior. PMID:19643542

  2. Liquid-Liquid Extraction and Solid Phase Extraction for Urinary Organic Acids: A Comparative Study from a Resource Constraint Setting.

    PubMed

    Kumari, Chandrawati; Varughese, Bijo; Ramji, Siddarth; Kapoor, Seema

    2016-10-01

    Pre analytical process of extraction for accurate detection of organic acids is a crucial step in diagnosis of organic acidemias by GCMS analysis. This process is accomplished either by solid phase extraction (SPE) or by liquid-liquid extraction (LLE). Both extraction procedures are used in different metabolic laboratories all over the world. In this study we compared these two extraction procedures in respect of precision, accuracy, percent recovery of metabolites, number of metabolites isolated, time and cost in a resource constraint setup. We observed that the mean recovery from SPE was 84.1 % and by LLE it was 77.4 % (p value <0.05). Moreover, the average number of metabolites isolated by SPE and LLE was 161.8 ± 18.6 and 140.1 ± 20.4 respectively. The processing cost of LLE was economical. In a cost constraint setting using LLE may be the practical option if used for organic acid analysis. PMID:27605738

  3. PREDICTION OF THE SOLUBILITY, ACTIVITY COEFFICIENT AND LIQUID/LIQUID PARTITION COEFFICIENT OF ORGANIC COMPOUNDS

    EPA Science Inventory

    Solvation models, based on fundamental chemical structure theory, were developed in the SPARC mechanistic tool box to predict a large array of physical properties of organic compounds in water and in non-aqueous solvents strictly from molecular structure. The SPARC self-interact...

  4. Organic Decomposition Performance of In-line Liquid Treatment System Using Microwave Plasma

    NASA Astrophysics Data System (ADS)

    Ito, Michiko; Takashima, Seigo; Nomura, Norio; Nomura, Tominori; Toyoda, Hirotaka

    2015-09-01

    Plasmas production in the vicinity of gas-liquid interface is expected as a new liquid treatment technique due to its high production rate of chemically reactive species (OH, O, etc.) and fast transfer of reactive species in liquid phase. So far, we have proposed a microwave plasma device using Venturi effect to treat a liquid, and have reported drastically-enhanced processing performance of organic decomposition by this plasma source. In this study, decomposition performance of various organic compounds such as phenol, methylene blue or diethylenetriamine is investigated. In the experiment, plasma is produced inside a gap between top and bottom parts of the nozzle by a pulsed 2.45 GHz microwave (peak power: <1.2 W, pulse repetition frequency: 10 kHz). During the plasma treatment, solutions are continuously supplied to the nozzle at a flow speed of 10.5 ~ 22.0 m/s. After the treatment, residual concentration is evaluated by high performance liquid chromatography, gas chromatography and so on. The result indicates the decomposition efficiency becomes different depending on organic matters. Origin of the efficiency difference will be discussed.

  5. Capture and release of mixed acid gasses with binding organic liquids

    DOEpatents

    Heldebrant, David J.; Yonker, Clement R.

    2010-09-21

    Reversible acid-gas binding organic liquid systems that permit separation and capture of one or more of several acid gases from a mixed gas stream, transport of the liquid, release of the acid gases from the ionic liquid and reuse of the liquid to bind more acid gas with significant energy savings compared to current aqueous systems. These systems utilize acid gas capture compounds made up of strong bases and weak acids that form salts when reacted with a selected acid gas, and which release these gases when a preselected triggering event occurs. The various new materials that make up this system can also be included in various other applications such as chemical sensors, chemical reactants, scrubbers, and separators that allow for the specific and separate removal of desired materials from a gas stream such as flue gas.

  6. Self-Assembled Fibers Containing Stable Organic Radical Moieties: Alignment and Magnetic Properties in Liquid Crystals.

    PubMed

    Eimura, Hiroki; Umeta, Yoshikazu; Tokoro, Hiroko; Yoshio, Masafumi; Ohkoshi, Shin-Ichi; Kato, Takashi

    2016-06-20

    Macroscopically oriented stable organic radicals have been obtained by using a liquid-crystalline (LC) gel composed of an l-isoleucine-based low molecular weight gelator containing a 2,2,6,6-tetramethylpiperidine 1-oxyl moiety. The LC gel has allowed magnetic measurements of the oriented organic radical. The gelator has formed fibrous aggregates in liquid crystals via intermolecular hydrogen bonds. The fibrous aggregates of the radical gelator are formed and oriented on cooling by applying a magnetic field to the mixture of liquid crystals and the gelator. Superconducting quantum interference device (SQUID) measurements have revealed that both oriented and nonoriented fibrous aggregates exhibited antiferromagnetic interactions, in which super-exchange interaction constant J is estimated as -0.89 cm(-1) . PMID:27219716

  7. The Recovery and Identification of Flammable Liquids in Suspected Arsons: An Undergraduate Organic Experiment

    ERIC Educational Resources Information Center

    Blackledge, Robert D.

    1974-01-01

    Describes an experiment which can be used to test for the use of accelerants in the origin of a fire. Involves distillation and gas liquid chromatography to identify the accelerants, thus combining two experiments ordinarily included in the beginning organic laboratory. (SLH)

  8. IMPACT OF ORGANIC COMPOUNDS ON THE CONCENTRATIONS OF LIQUID WATER IN AMBIENT PM2.5

    EPA Science Inventory

    A field study was undertaken during the summer of 2000 to assess the impact of the presence of organic compounds on the liquid water concentrations of PM2.5 samples. The selected site, located in Research Triangle Park, North Carolina, was in a semi-rural environment with expe...

  9. Dissolution, Cyclodextrin-Enhanced Solubilization, and Mass Removal of an Ideal Multicomponent Organic Liquid

    PubMed Central

    Carroll, Kenneth C.; Brusseau, Mark L.

    2010-01-01

    Laboratory experiments and mathematical modeling were conducted to examine the influence of a hydroxypropyl-beta-cyclodextrin (HPCD) solution on the dissolution of single- and three-component organic liquids. The results of batch experiments showed that HPCD-enhanced solubilization of the organic-liquid mixtures was ideal (describable using Raoult’s Law), and that solubilization-enhancement factors were independent of mixture composition. Addition of the HPCD solution to columns containing residual saturations of the organic liquid enhanced the dissolution and removal of all three compounds in the mixture. The results of the column experiments and multicomponent rate-limited dissolution modeling suggest that solubilization was ideal for both water and cyclodextrin flushing. Concomitantly, the mass-flux reduction versus mass removal behavior was ideal for all experiments. Mass transfer was increased for HPCD solubilization relative to the water flushing due to solubility and concentration-gradient enhancement. Organic-liquid composition did not significantly impact mass transfer coefficients, and fractional mass removal behavior during HPCD solubilization was nearly identical for each compound whether present as a single component or in a mixture. Additionally, mass transfer coefficients for aqueous and HPCD solubilization for single and multicomponent mixtures were not statistically different upon normalizing by the solubility enhancement factor. PMID:19233508

  10. Fertigation with liquid fish emulsion for organic production of highbush blueberry

    Technology Transfer Automated Retrieval System (TEKTRAN)

    Liquid fish emulsion is a common fertilizer used for organic production of highbush blueberry. The product is often applied by hand or with a sprayer but can also be injected through a drip irrigation system, otherwise referred to as fertigation. Fertigation is more efficient and less labor-intensiv...

  11. ON-LINE DEOXYGENATION IN REDUCTIVE (AND OXIDATIVE) AMPEROMETRIC DETECTION: ENVIRONMENTAL APPLICATIONS IN THE LIQUID CHROMATOGRAPHY OF ORGANIC PEROXIDES

    EPA Science Inventory

    Cyclic voltammetry was used qualitatively to characterize and determine the feasibility of the oxidation and reduction of selected organic peroxides and hydroperoxides at a glassy carbon electrode. Organic peroxides were determined using reversed-phase high-performance liquid chr...

  12. EVALUATION OF A CONTINUOUS LIQUID-LIQUID EXTRACTOR FOR ISOLATION AND CONCENTRATION OF NONPOLAR ORGANICS FOR BIOLOGICAL TESTING IN THE PRESENCE OF HUMIC MATERIALS

    EPA Science Inventory

    A continuous liquid-liquid extraction system (CLLE) for concentrating trace organics from water into methylene chloride for analysis was designed, built and evaluated. The CLLE uses Teflon coils for phase contact and gravity phase separation. The system includes a self-contained ...

  13. EVALUATION OF A TEFLON HELIX LIQUID-LIQUID EXTRACTOR FOR CONCENTRATION OF TRACE ORGANICS FROM WATER INTO METHYLENE CHLORIDE (JOURNAL VERSION)

    EPA Science Inventory

    A continuous liquid-liquid extraction system (CLLE) for concentrating trace organics from water into methylene chloride for analysis was designed, built and evaluated. The CLLE uses Teflon coils for phase contact and gravity phase separation. The system includes a self-contained ...

  14. Formation and organization of planar polymeric and nanocomposite nanostructures on liquid and solid surfaces

    NASA Astrophysics Data System (ADS)

    Khomutov, G. B.; Gainutdinov, R. V.; Gubin, S. P.; Kislov, V. V.; Rakhnyanskaya, A. A.; Sergeev-Cherenkov, A. N.; Tolstikhina, A. L.

    2004-09-01

    We describe a new approach to fabrication of organized planar polymeric and composite nanostructures based on synthetic reactions in organized polymeric Langmuir monolayer at the gas-liquid interface. Novel polymeric quasi-crystalline planar monomolecular structures were formed at the gas-aqueous phase interface using new water-insoluble amphiphilic polyelectrolyte molecules. Corresponding ultrathin polymeric nanoscale-ordered films and stable planar polymeric nanocomposite structures with organized inorganic nanoparticles (palladium, gold and iron oxide) grown in the polymeric monolayer were formed successfully on the solid substrate surfaces. The obtained nanostructures were characterized by atomic force microscopy and transmission electron microscopy techniques.

  15. Computation of liquid-liquid equilibria and phase stabilities: implications for RH-dependent gas/particle partitioning of organic-inorganic aerosols

    NASA Astrophysics Data System (ADS)

    Zuend, A.; Marcolli, C.; Peter, T.; Seinfeld, J. H.

    2010-08-01

    Semivolatile organic and inorganic aerosol species partition between the gas and aerosol particle phases to maintain thermodynamic equilibrium. Liquid-liquid phase separation into an organic-rich and an aqueous electrolyte phase can occur in the aerosol as a result of the salting-out effect. Such liquid-liquid equilibria (LLE) affect the gas/particle partitioning of the different semivolatile compounds and might significantly alter both particle mass and composition as compared to a one-phase particle. We present a new liquid-liquid equilibrium and gas/particle partitioning model, using as a basis the group-contribution model AIOMFAC (Zuend et al., 2008). This model allows the reliable computation of the liquid-liquid coexistence curve (binodal), corresponding tie-lines, the limit of stability/metastability (spinodal), and further thermodynamic properties of multicomponent systems. Calculations for ternary and multicomponent alcohol/polyol-water-salt mixtures suggest that LLE are a prevalent feature of organic-inorganic aerosol systems. A six-component polyol-water-ammonium sulphate system is used to simulate effects of relative humidity (RH) and the presence of liquid-liquid phase separation on the gas/particle partitioning. RH, salt concentration, and hydrophilicity (water-solubility) are identified as key features in defining the region of a miscibility gap and govern the extent to which compound partitioning is affected by changes in RH. The model predicts that liquid-liquid phase separation can lead to either an increase or decrease in total particulate mass, depending on the overall composition of a system and the particle water content, which is related to the hydrophilicity of the different organic and inorganic compounds. Neglecting non-ideality and liquid-liquid phase separations by assuming an ideal mixture leads to an overestimation of the total particulate mass by up to 30% for the composition and RH range considered in the six-component system

  16. Computation of liquid-liquid equilibria and phase stabilities: implications for RH-dependent gas/particle partitioning of organic-inorganic aerosols

    NASA Astrophysics Data System (ADS)

    Zuend, A.; Marcolli, C.; Peter, T.; Seinfeld, J. H.

    2010-05-01

    Semivolatile organic and inorganic aerosol species partition between the gas and aerosol particle phases to maintain thermodynamic equilibrium. Liquid-liquid phase separation into an organic-rich and an aqueous electrolyte phase can occur in the aerosol as a result of the salting-out effect. Such liquid-liquid equilibria (LLE) affect the gas/particle partitioning of the different semivolatile compounds and might significantly alter both particle mass and composition as compared to a one-phase particle. We present a new liquid-liquid equilibrium and gas/particle partitioning model, using as a basis the group-contribution model AIOMFAC (Zuend et al., 2008). This model allows the reliable computation of the liquid-liquid coexistence curve (binodal), corresponding tie-lines, the limit of stability/metastability (spinodal), and further thermodynamic properties of the phase diagram. Calculations for ternary and multicomponent alcohol/polyol-water-salt mixtures suggest that LLE are a prevalent feature of organic-inorganic aerosol systems. A six-component polyol-water-ammonium sulphate system is used to simulate effects of relative humidity (RH) and the presence of liquid-liquid phase separation on the gas/particle partitioning. RH, salt concentration, and hydrophilicity (water-solubility) are identified as key features in defining the region of a miscibility gap and govern the extent to which compound partitioning is affected by changes in RH. The model predicts that liquid-liquid phase separation can lead to either an increase or decrease in total particulate mass, depending on the overall composition of a system and the particle water content, which is related to the hydrophilicity of the different organic and inorganic compounds. Neglecting non-ideality and liquid-liquid phase separations by assuming an ideal mixture leads to an overestimation of the total particulate mass by up to 30% for the composition and RH range considered in the six-component system simulation

  17. Safety analysis of exothermic reaction hazards associated with the organic liquid layer in tank 241-C-103

    SciTech Connect

    Postma, A.K.; Bechtold, D.B.; Borsheim, G.L.; Grisby, J.M.; Guthrie, R.L.; Kummerer, M.; Turner, D.A.; Plys, M.G.

    1994-03-01

    Safety hazards associated with the interim storage of a potentially flammable organic liquid in waste Tank C-103 are identified and evaluated. The technical basis for closing the unreviewed safety question (USQ) associated with the floating liquid organic layer in this tank is presented.

  18. CO2-Binding-Organic-Liquids-Enhanced CO2 Capture using Polarity-Swing-Assisted Regeneration

    SciTech Connect

    Zhang, Jian; Kutnyakov, Igor; Koech, Phillip K.; Zwoster, Andy; Howard, Chris; Zheng, Feng; Freeman, Charles J.; Heldebrant, David J.

    2013-01-01

    A new solvent-based CO2 capture process couples the unique attributes of non-aqueous, CO2-binding organic liquids (CO2BOLs) with the newly discovered polarity-swing-assisted regeneration (PSAR) process that is unique to switchable ionic liquids. Laboratory measurements with PSAR indicate the ability to achieve a regeneration effect at 75°C comparable to that at 120°C using thermal regeneration only. Initial measurements also indicate that the kinetic behavior of CO2 release is also improved with PSAR. Abstract cleared PNWD-SA-9743

  19. Cationic Ionic Liquids Organic Ligands Based Metal-Organic Frameworks for Fabrication of Core-Shell Microspheres for Hydrophilic Interaction Liquid Chromatography.

    PubMed

    Dai, Qian; Ma, Junqian; Ma, Siqi; Wang, Shengyu; Li, Lijun; Zhu, Xianghui; Qiao, Xiaoqiang

    2016-08-24

    In this study, new metal-organic frameworks (MOFs) nanocrystals modified SiO2 core-shell microspheres were designed with cationic ionic liquids (ILs) 1,3-bis(4-carboxybutyl)imidazolium bromide (ILI) as organic ligands. By further adjustment the growth cycles, the new ILI-01@SiO2 core-shell stationary phase was facilely fabricated. The developed stationary phase was respectively characterized via element analysis, thermogravimetric analysis, scanning electron microscopy, X-ray diffraction, and Fourier transform infrared spectrometry. Because the introduction of cationic imidazolium-based ILs ILI for fabrication of the MOFs nanocrystals shell, the new stationary phase exhibits the retention mechanism of hydrophilic interaction liquid chromatography (HILIC). Many polar samples, such as amides, vitamins, nucleic acid bases, and nucleosides, were utilized to investigate the performance of the prepared ILI-01@SiO2 column. Compared to the conventional aminosilica column, the new ILI-01@SiO2 column displays high separation selectivity in a shorter separation time. Furthermore, the new ILI-01@SiO2 column was also used for detection of illegal melamine addition in the baby formula. All the above results demonstrate the new ILI-01@SiO2 core-shell stationary phase is of good potentials for high-selectivity separation the polar samples. PMID:27483161

  20. Determination of 13 Organic Toxicants in Human Blood by Liquid-Liquid Extraction Coupling High-Performance Liquid Chromatography Tandem Mass Spectrometry.

    PubMed

    Song, Aiying

    2016-01-01

    Pesticides and antidepressants are frequently misused in drug-facilitated crime because of their toxicological effect and easy-availability. Therefore, it is essential for the development of a simple and reliable method for the determination of these organic toxicants in biological fluids. Here, we report on an applicable method by the combination of optimized liquid-liquid extraction (LLE) procedure and high-performance liquid chromatography-tandem mass spectrometry (HPLC-MS/MS) to identify and quantify dimethoate, omethoate, dichlorvos, carbofuran, fenpropathrin, diazepam, estazolam, alprazolam, triazolamm, chlorpromazine, phenergan, barbitone and phenobarbital in human blood. The method demonstrated a linear calibration curve in range of 20 - 500 μg/L (r > 0.994). The accuracy evaluated by recovery spiked at three different concentrations (50, 100 and 200 μg/L) was in the range of 58.8 - 83.1% with a relative standard deviations (RSD) of 3.7 - 7.4%. The limits of quantification ranged over 6.7 - 33.3 μg/L. This method was proved to be simple and reliable, and was thus successfully applied to forensic toxicology. PMID:27302585

  1. Evaluation of industrially applied heat-transfer fluids as liquid organic hydrogen carrier systems.

    PubMed

    Brückner, Nicole; Obesser, Katharina; Bösmann, Andreas; Teichmann, Daniel; Arlt, Wolfgang; Dungs, Jennifer; Wasserscheid, Peter

    2014-01-01

    Liquid organic hydrogen carrier (LOHC) systems offer a very attractive method for the decentralized storage of renewable excess energy. In this contribution, industrially well-established heat-transfer oils (typically sold under trade names, e.g., Marlotherm) are proposed as a new class of LOHC systems. It is demonstrated that the liquid mixture of isomeric dibenzyltoluenes (m.p. -39 to -34 °C, b.p. 390 °C) can be readily hydrogenated to the corresponding mixture of perhydrogenated analogues by binding 6.2 wt% of H2. The liquid H2 -rich form can be stored and transported similarly to diesel fuel. It readily undergoes catalytic dehydrogenation at temperatures above 260 °C, which proves its applicability as a reversible H2 carrier. The presented LOHC systems are further characterized by their excellent technical availability at comparably low prices, full registration of the H2 -lean forms, and excellent thermal stabilities. PMID:23956191

  2. Fast Scanning Calorimetry study of non-equilibrium relaxation in fragile organic liquids

    NASA Astrophysics Data System (ADS)

    Sadtchenko, Vlad; Bhattacharya, Deepanjan; O'Reilly, Liam

    2013-03-01

    Fast scanning calorimetry (FSC), capable of heating rates in excess of 1000000 K/s, was combined with vapor deposition technique to investigate non-equilibrium relaxation in micrometer thick viscous liquid films of several organic compounds (e.g.2-ethyl-1-hexanol, Toluene, and 1-propanol) under high vacuum conditions. Rapid heating of samples, vapor deposited at temperatures above their standard glass softening transition (Tg), resulted in observable endotherms which onset temperatures were strongly dependent on heating rate and the deposition temperature. Furthermore, all of the studied compounds were characterized by distinct critical deposition temperatures at which observation of endotherm became impossible. Based on the results of these studies, we have developed a simple model which makes it possible to infer the equilibrium enthalpy relaxation times for liquids from FSC data. We will discuss implications of these studies for contemporary models of non-equilibrium relaxation in glasses and supercooled liquids. Supported by NSF Grant 1012692.

  3. Nature of Mesoscopic Organization in Protic Ionic Liquid-Alcohol Mixtures.

    PubMed

    Schroer, Wolffram; Triolo, Alessandro; Russina, Olga

    2016-03-10

    The mesoscopic morphology of mixtures of ethylammonium nitrate, a protic ionic liquid, and n-pentanol is explored for the first time using small angle X-ray scattering as a function of concentration and temperature. Both compounds are amphiphilic and characterized by an extended hydrogen bonding network; however, though macroscopically homogeneous, their mixtures are highly heterogeneous at the mesoscopic spatial scales. Previous structural studies rationalized similar features in related mixtures proposing the existence of large aggregates or micelle- and/or microemulsion-like structures. Here we show that a detailed analysis of the present concentration and temperature resolved experimental data set supports a structural scenario where the mesoscopic heterogeneities are the due to density fluctuations that are precursors of liquid-liquid phase separation. Accordingly no existence of structurally organized aggregates (such as micellar or microemulsion aggregates) is required to account for the mesoscopic heterogeneities detected in this class of binary mixtures. PMID:26895177

  4. Improved Device Lifetime of Organic Light Emitting Diodes with an Electrochemically Stable π-Conjugated Liquid Host in the Liquid Emitting Layer

    NASA Astrophysics Data System (ADS)

    Hirata, Shuzo; Heo, Hyo Jung; Shibano, Yuki; Hirata, Osamu; Yahiro, Masayuki; Adachi, Chihaya

    2012-04-01

    The device lifetimes of organic light emitting diodes with a liquid emitting layer (liquid OLEDs) were improved by proper combination of host and guest molecules in the liquid emitting layer. The device lifetime strongly depends on the electrochemical stability of radical cations in the liquid emitting layer. The electrochemical stability of the liquid host materials was achieved by the dimerization of the alkyl-substituted carbazole 9,9'-2-[2-(2-methoxyethoxy)ethoxy]ethyl-3,3'-bis(9H-carbazole) [(TEGCz)2]. The use of a guest compound with its highest occupied molecular orbital level higher in energy than that of (TEGCz)2 is a critical factor for realizing stable electroluminescence performance. A liquid OLED with proper combination of the guest and host materials showed an improved device lifetime of longer than 1 h, which is 100 times longer than that of our previous reports.

  5. Chemical Reactivity and Liquid/Nonliquid States of Secondary Organic Material.

    PubMed

    Li, Yong Jie; Liu, Pengfei; Gong, Zhaoheng; Wang, Yan; Bateman, Adam P; Bergoend, Clara; Bertram, Allan K; Martin, Scot T

    2015-11-17

    The reactivity of secondary organic material (SOM) of variable viscosity, ranging from nonliquid to liquid physical states, was studied. The SOM, produced in aerosol form from terpenoid and aromatic precursor species, was reacted with ammonia at variable relative humidity (RH). The ammonium-to-organic mass ratio (MNH4+/MOrg) increased monotonically from <5% RH to a limiting value at a threshold RH, implicating a transition from particle reactivity limited by diffusion at low RH to one limited by other factors at higher RH. For the studied size distributions and reaction times, the transition corresponded to a diffusivity above 10-17.5 ± 0.5 m2 s-1. The threshold RH values for the transition were <5% RH for isoprene-derived SOM, 35-45% RH for SOM derived from α-pinene, toluene, m-xylene, and 1,3,5-trimethylbenzene, and >90% for β-caryophyllene-derived SOM. The transition RH for reactivity differed in all cases from the transition RH of a nonliquid to a liquid state. For instance, for α-pinene-derived SOM the transition for chemical reactivity of 35-45% RH can be compared to the nonliquid to liquid transition of 65-90% RH. These differences imply that chemical transport models of atmospheric chemistry should not use the SOM liquid to nonliquid phase transition as one-to-one surrogates of SOM reactivity. PMID:26465059

  6. Comparison of imidazolium ionic liquids and traditional organic solvents: effect on activated sludge processes.

    PubMed

    Gendaszewska, Dorota; Liwarska-Bizukojc, Ewa

    2013-01-01

    Data concerning the biodegradability and ecotoxicity of ionic liquids (ILs) obtained so far are insufficient in the context of IL removal from wastewater in activated sludge systems. Thus, in this work the selected imidazolium ionic liquids and two organic solvents (methanol and acetone) were tested with respect to their influence on activated sludge processes, particularly on the morphology of sludge flocs. The presence of ionic liquids with the chemical structure of 1-alkyl-3-methyl imidazolium bromide in wastewater did not deteriorate biological wastewater treatment processes if their concentration was not higher than 5 mg l(-1). Regarding the structure of the ILs studied, the longer the alkyl substituent was, the stronger the effect on sludge flocs. The highest decrease in activated sludge floc area and biomass concentration was exerted by the ionic liquid with the longest alkyl chain, i.e. 1-decyl-3-methylimidazolium bromide. The action of both methanol and acetone on floc size, activated sludge concentration and efficiency of organic pollutants removal was weaker compared to all tested 1-alkyl-3-methyl imidazolium bromides. PMID:24355854

  7. Application of liquid chromatography-tandem mass spectrometry in quantitative bioanalyses of organic molecules in aquatic environment and organisms.

    PubMed

    Bussy, Ugo; Li, Ke; Li, Weiming

    2016-05-01

    Analytical methods using liquid chromatography coupled to tandem mass spectrometry (LC-MS/MS) for the simultaneous determination of metabolites or contaminants (or both) in various tissues of aquatic organisms and in the aquatic environment have received increasing attention in the last few years. This review discusses the findings relevant to such procedures published between 2005 and 2015. The aim is to evaluate the advantages, restrictions, and performances of the procedures from sample preparation to mass spectrometry measurement. To support these discussions, a general knowledge on LC-MS/MS is also provided. PMID:26996906

  8. A novel liquid organic hydrogen carrier system based on catalytic peptide formation and hydrogenation

    PubMed Central

    Hu, Peng; Fogler, Eran; Diskin-Posner, Yael; Iron, Mark A.; Milstein, David

    2015-01-01

    Hydrogen is an efficient green fuel, but its low energy density when stored under high pressure or cryogenically, and safety issues, presents significant disadvantages; hence finding efficient and safe hydrogen carriers is a major challenge. Of special interest are liquid organic hydrogen carriers (LOHCs), which can be readily loaded and unloaded with considerable amounts of hydrogen. However, disadvantages include high hydrogen pressure requirements, high reaction temperatures for both hydrogenation and dehydrogenation steps, which require different catalysts, and high LOHC cost. Here we present a readily reversible LOHC system based on catalytic peptide formation and hydrogenation, using an inexpensive, safe and abundant organic compound with high potential capacity to store and release hydrogen, applying the same catalyst for loading and unloading hydrogen under relatively mild conditions. Mechanistic insight of the catalytic reaction is provided. We believe that these findings may lead to the development of an inexpensive, safe and clean liquid hydrogen carrier system. PMID:25882348

  9. Basic technology for 6Li enrichment using an ionic-liquid impregnated organic membrane

    NASA Astrophysics Data System (ADS)

    Hoshino, Tsuyoshi; Terai, Takayuki

    2011-10-01

    The tritium needed as a fuel for fusion reactors is produced by the neutron capture reaction of lithium-6 ( 6Li) in tritium breeding materials. However, natural Li contains only about 7.6 at.% 6Li. In this paper, a new lithium isotope separation technique using an ionic-liquid impregnated organic membrane is proposed. In order to separate and concentrate lithium isotopes, only lithium ions are able to move through the membrane by electrodialysis between the cathode and the anode in lithium solutions. Preliminary experiments of lithium isotope separation were conducted using this phenomenon. Organic membranes impregnated with TMPA-TFSI and PP13-TFSI as ionic liquids were prepared, and the relationship between the 6Li separation coefficient and the applied electrodialytic conditions was evaluated using them. The results showed that the 6Li isotope separation coefficient in this method (about 1.1-1.4) was larger than that in the mercury amalgam method (about 1.06).

  10. Fast, non-linear optical-scattering spectroscopy in shock-compressed organic liquids

    SciTech Connect

    Schmidt, S.C.; Moore, D.S.; Schiferl, D.; Shaner, J.W.

    1983-01-01

    Nanosecond stimulated Raman and coherent anti-Stokes Raman scattering spectroscopy have been used to determine molecular vibrational frequency shifts and changes of phase in shock-compressed organic liquids. Results of dynamic experiments are compared to static Raman scattering measurements of samples, compressed and heated in a diamond-anvil cell. Objectives of the experiments are to determine the molecular structure and ultimately the energy transfer mechanisms in shock-compressed condensed phase materials.

  11. Technical Assessment of Organic Liquid Carrier Hydrogen Storage Systems for Automotive Applications

    SciTech Connect

    Ahluwalia, R. K.; Hua, T. Q.; Peng, J. -K; Kromer, M.; Lasher, S.; McKenney, K.; Law, K.; Sinha, J.

    2011-06-21

    In 2007-2009, the DOE Hydrogen Program conducted a technical assessment of organic liquid carrier based hydrogen storage systems for automotive applications, consistent with the Program’s Multiyear Research, Development, and Demonstration Plan. This joint performance (ANL) and cost analysis (TIAX) report summarizes the results of this assessment. These results should be considered only in conjunction with the assumptions used in selecting, evaluating, and costing the systems discussed here and in the Appendices.

  12. Metal-organic frameworks as host materials of confined supercooled liquids

    NASA Astrophysics Data System (ADS)

    Fischer, J. K. H.; Sippel, P.; Denysenko, D.; Lunkenheimer, P.; Volkmer, D.; Loidl, A.

    2015-10-01

    In this work, we examine the use of metal-organic framework (MOF) systems as host materials for the investigation of glassy dynamics in confined geometry. We investigate the confinement of the molecular glass former glycerol in three MFU-type MOFs with different pore sizes (MFU stands for "Metal-Organic Framework Ulm-University") and study the dynamics of the confined liquid via dielectric spectroscopy. In accord with previous reports on confined glass formers, we find different degrees of deviations from bulk behavior depending on pore size, demonstrating that MOFs are well-suited host systems for confinement investigations.

  13. Organic salt-assisted liquid-phase exfoliation of graphite to produce high-quality graphene

    NASA Astrophysics Data System (ADS)

    Du, Wencheng; Lu, Jie; Sun, Peipei; Zhu, Yinyan; Jiang, Xiaoqing

    2013-05-01

    Certain ordinary organic salts, such as edetate disodium, sodium tartrate, potassium sodium tartrate and sodium citrate were found to have universal and efficient assistant effect for liquid-phase exfoliation of graphite in common organic solvents to produce pristine graphene. Up to 123 times enhanced exfoliation efficiency was observed when sodium citrate was introduced into an exfoliation system consisting of natural graphite powder and dimethyl sulfoxide. TEM, AFM, Raman spectroscopy, EDX, TGA, and FTIR analysis showed graphite was successfully exfoliated into single or few-layer graphene nanosheets which were free of defects and oxides. The method is simple, effective, safe and economical.

  14. Parameterizing liquid crystal variable retarder structural organization with a fractal-Born approximation model

    NASA Astrophysics Data System (ADS)

    Gladish, James C.; Duncan, Donald D.

    2016-05-01

    Liquid crystal variable retarders (LCVRs) are computer-controlled birefringent devices that contain nanometer-sized birefringent liquid crystals (LCs). These devices impart retardance effects through a global, uniform orientation change of the LCs, which is based on a user-defined drive voltage input. In other words, the LC structural organization dictates the device functionality. The LC structural organization also produces a spectral scatter component which exhibits an inverse power law dependence. We investigate LC structural organization by measuring the voltage-dependent LC spectral scattering signature with an integrating sphere and then relate this observable to a fractal-Born model based on the Born approximation and a Von Kármán spectrum. We obtain LCVR light scattering spectra at various drive voltages (i.e., different LC orientations) and then parameterize LCVR structural organization with voltage-dependent correlation lengths. The results can aid in determining performance characteristics of systems using LCVRs and can provide insight into interpreting structural organization measurements.

  15. Positive-ion thermospray liquid chromatography-mass spectrometry: detection of organic acidurias.

    PubMed

    Buchanan, D N; Muenzer, J; Thoene, J G

    1990-12-14

    Positive-ion thermospray liquid chromatography-mass spectrometry (TSP-LC-MS) is used to detect organic acids via the direct injection of untreated urine from newborns and infants. Two methods are reported for the separation of organic acids. The separation of urinary organic acids is effected in either an acidic, pH 2.5 sulfuric acid, or a non-acidic, 0.05 M ammonium acetate, pH 6.8, mobile phase. Use of pH 2.5 sulfuric acid and an HPX-87H organic acid column produces better separation but has less sensitivity than the use of 0.05 M ammonium acetate, pH 6.8 and a C18 column. Positive ion TSP-LC-MS has been used to detect methylmalonic aciduria, 3-hydroxy-3-methylglutaric aciduria, propionic aciduria, isovaleric aciduria and argininosuccinic aciduria. PMID:1709942

  16. Capabilities and limitations of dispersive liquid-liquid microextraction with solidification of floating organic drop for the extraction of organic pollutants from water samples.

    PubMed

    Vera-Avila, Luz E; Rojo-Portillo, Tania; Covarrubias-Herrera, Rosario; Peña-Alvarez, Araceli

    2013-12-17

    Dispersive liquid-liquid microextraction with solidification of floating organic drop (DLLME-SFO) is one of the most interesting sample preparation techniques developed in recent years. Although several applications have been reported, the potentiality and limitations of this simple and rapid extraction technique have not been made sufficiently explicit. In this work, the extraction efficiency of DLLME-SFO for pollutants from different chemical families was determined. Studied compounds include: 10 polycyclic aromatic hydrocarbons, 5 pesticides (chlorophenoxy herbicides and DDT), 8 phenols and 6 sulfonamides, thus, covering a large range of polarity and hydrophobicity (LogKow 0-7, overall). After optimization of extraction conditions using 1-dodecanol as extractant, the procedure was applied for extraction of each family from 10-mL spiked water samples, only adjusting sample pH as required. Absolute recoveries for pollutants with LogKow 3-7 were >70% and recovery values within this group (18 compounds) were independent of structure or hydrophobicity; the precision of recovery was very acceptable (RSD<12%) and linear behavior was observed in the studied concentration range (r(2)>0.995). Extraction recoveries for pollutants with LogKow 1.46-2.8 were in the range 13-62%, directly depending on individual LogKow values; however, good linearity (r(2)>0.993) and precision (RSD<6.5%) were also demonstrated for these polar solutes, despite recovery level. DLLME-SFO with 1-dodecanol completely failed for extraction of compounds with LogKow≤1 (sulfa drugs), other more polar extraction solvents (ionic liquids) should be explored for highly hydrophilic pollutants. PMID:24296144

  17. Insights into Mechanistic Models for Evaporation of Organic Liquids in the Environment Obtained by Position-Specific Carbon Isotope Analysis.

    PubMed

    Julien, Maxime; Nun, Pierrick; Robins, Richard J; Remaud, Gérald S; Parinet, Julien; Höhener, Patrick

    2015-11-01

    Position-specific isotope effects (PSIEs) have been measured by isotope ratio monitoring (13)C nuclear magnetic resonance spectrometry during the evaporation of 10 liquids of different polarities under 4 evaporation modes (passive evaporation, air-vented evaporation, low pressure evaporation, distillation). The observed effects are used to assess the validity of the Craig-Gordon isotope model for organic liquids. For seven liquids the overall isotope effect (IE) includes a vapor-liquid contribution that is strongly position-specific in polar compounds but less so in apolar compounds and a diffusive IE that is not position-specific, except in the alcohols, ethanol and propan-1-ol. The diffusive IE is diminished under forced evaporation. The position-specific isotope pattern created by liquid-vapor IEs is manifest in five liquids, which have an air-side limitation for volatilization. For the alcohols, undefined processes in the liquid phase create additional PSIEs. Three other liquids with limitations on the liquid side have a lower, highly position-specific, bulk diffusive IE. It is concluded that evaporation of organic pollutants creates unique position-specific isotope patterns that may be used to assess the progress of remediation or natural attenuation of pollution and that the Craig-Gordon isotope model is valid for the volatilization of nonpolar organic liquids with air-side limitation of the volatilization rate. PMID:26443423

  18. Pyrolysis characteristics and pyrolysis products separation for recycling organic materials from waste liquid crystal display panels.

    PubMed

    Wang, Ruixue; Xu, Zhenming

    2016-01-25

    Waste liquid crystal display (LCD) panels mainly contain inorganic materials (glass substrate with indium-tin oxide film), and organic materials (polarizing film and liquid crystal). The organic materials should be removed beforehand since the organic matters would hinder the indium recycling process. In the present study, pyrolysis process is used to remove the organic materials and recycle acetic as well as and triphenyl phosphate (TPP) from waste LCD panels in an environmental friendly way. Several highlights of this study are summarized as follows: (i) Pyrolysis characteristics and pyrolysis kinetics analysis are conducted which is significant to get a better understanding of the pyrolysis process. (ii) Optimum design is developed by applying Box-Behnken Design (BBD) under response surface methodology (RSM) for engineering application which is significant to guide the further industrial recycling process. The oil yield could reach 70.53 wt% and the residue rate could reach 14.05 wt% when the pyrolysis temperature is 570 °C, nitrogen flow rate is 6 L min(-1) and the particle size is 0.5 mm. (iii) Furthermore, acetic acid and TPP are recycled, and then separated by rotary evaporation, which could reduce the consumption of fossil energy for producing acetic acid, and be reused in electronics manufacturing industry. PMID:26444486

  19. Chromatographic behavior of small organic compounds in low-temperature high-performance liquid chromatography using liquid carbon dioxide as the mobile phase.

    PubMed

    Motono, Tomohiro; Nagai, Takashi; Kitagawa, Shinya; Ohtani, Hajime

    2015-07-01

    Low-temperature high-performance liquid chromatography, in which a loop injector, column, and detection cell were refrigerated at -35ºC, using liquid carbon dioxide as the mobile phase was developed. Small organic compounds (polyaromatic hydrocarbons, alkylbenzenes, and quinones) were separated by low-temperature high-performance liquid chromatography at temperatures from -35 to -5ºC. The combination of liquid carbon dioxide mobile phase with an octadecyl-silica (C18 ) column provided reversed phase mode separation, and a bare silica-gel column resulted in normal phase mode separation. In both the cases, nonlinear behavior at approximately -15ºC was found in the relationship between the temperature and the retention factors of the analytes (van't Hoff plots). In contrast to general trends in high-performance liquid chromatography, the decrease in temperature enhanced the separation efficiency of both the columns. PMID:25917311

  20. Assessment of survivability of liquid water and organic materials through modeling of large-scale impacts

    NASA Astrophysics Data System (ADS)

    Blank, Jennifer

    Comets, estimated to contain up to 25 wt.% organic material as both ices and more complex, refractory compounds, have been proposed as a vehicle for the delivery of organic compounds to the early Earth and other rocky planets. Successful delivery requires that some of the organic materials survive the extreme temperatures associated with impact, but the response of organic compounds to impact (shock) processing under these conditions is unknown. Several researchers have explored organic-delivery scenarios computationally and experimentally. Here, I will summarize work that addresses the issue of impact delivery and focus on current efforts to track the phase-state of water during a modeled comet-earth collision over a range of impact angles. On the basis of model results generated using a three-dimensional shock physics code (GEODYN), I will infer survivability of organic compounds and liquid water in a range of impact scenarios for comet-Earth and asteroid-Earth collisions. These results will be described in the context of the flux of astromaterials, and organic matter in particular, to young planets.

  1. Ionic Liquids Beyond Simple Solvents: Glimpses at the State of the Art in Organic Chemistry

    PubMed Central

    Kuchenbuch, Andrea

    2015-01-01

    Abstract Within the last 25 years ionic liquids have written a tremendous success story, which is documented in a nearly uncountable amount of original research papers, reviews, and numerous applications in research and industry. These days, ionic liquids can be considered as a mature class of compounds for many different applications. Frequently, they are used as neoteric solvents for chemical tansformations, and the number of reviews on this field of research is huge. In this focused review, though, we are trying to evaluate the state of the art of ionic liquid chemistry beyond using them simply as solvents for chemical transformations. It is not meant to be a comprehensive overview on the topic; the choice of emphasis and examples rather refects the authors’ personal view on the field. We are especially highlighting fields in which we believe the most fundamental developments within the next five years will take place: biomass processing, (chiral) ionic liquids from natural sources, biotransformations, and organic synthesis. PMID:27308192

  2. Self-organized assemblies of colloidal particles obtained from an aligned chromonic liquid crystal dispersion.

    PubMed

    Zimmermann, Natalie; Jünnemann-Held, Gisela; Collings, Peter J; Kitzerow, Heinz-S

    2015-02-28

    The behavior of mono-disperse colloidal particles in a chromonic liquid crystal was investigated. Poly(methyl methacrylate) spherical particles with three different functionalizations, with and without surface charges, were utilized in the nematic and columnar phases of disodium cromoglycate solutions. The nematic phase was completely aligned parallel to the glass substrates by a simple rubbing technique, and the columnar phase showed regions of similar alignment. The behavior of the colloidal particles in the chromonic liquid crystal depended critically on the functionality, with bromine functionalized particles not dispersing at all, and cationic trimethylammonium and epoxy functionalized particles dispersing well in the isotropic phase of the liquid crystal. At the transition to the nematic and especially the columnar phase, the colloidal particles were expelled into the remaining isotropic phase. Since the columnar phase grew in parallel ribbons, the colloidal particles ended up in chain-like assemblies. Such behavior opens the possibility of producing patterned assemblies of colloidal particles by taking advantage of the self-organized structure of chromonic liquid crystals. PMID:25589441

  3. Development of a new neutron monitor using a boron-loaded organic liquid scintillation detector

    NASA Astrophysics Data System (ADS)

    Rasolonjatovo, A. H. D.; Shiomi, T.; Kim, E.; Nakamura, T.; Nunomiya, T.; Endo, A.; Yamaguchi, Y.; Yoshizawa, M.

    2002-10-01

    A new type of neutron dose monitor was developed by using a 12.7 cm diameter×12.7 cm long boron-loaded organic liquid scintillation detector BC523A. This detector aims to have a response in the wide energy range of thermal energy to 100 MeV by using the H and C reactions to the fast neutrons of organic liquid and the 10B(n, α) reaction to thermalized neutrons in the liquid. The response functions of this detector were determined by the Monte Carlo simulation in the energy region from thermal energy to 100 MeV. Using these response functions, the spectrum-weighted dose function, G-function, to get the neutron dose from the light output spectrum of the detector was also determined by the unfolding technique. The calculated G-function was applied to determine the neutron dose in real neutron fields having energies ranging from thermal energy to several tens of MeV, where the light output spectra were measured with the BC523A detector. The thus-obtained ambient doses and effective doses show rather good agreement with the fluence-to-dose conversion factor given by ICRP 74. This detector will be useful as a wide-energy range neutron monitor.

  4. The electro-structural behaviour of yarn-like carbon nanotube fibres immersed in organic liquids

    NASA Astrophysics Data System (ADS)

    Terrones, Jeronimo; Windle, Alan H.; Elliott, James A.

    2014-10-01

    Yarn-like carbon nanotube (CNT) fibres are a hierarchically-structured material with a variety of promising applications such as high performance composites, sensors and actuators, smart textiles, and energy storage and transmission. However, in order to fully realize these possibilities, a more detailed understanding of their interactions with the environment is required. In this work, we describe a simplified representation of the hierarchical structure of the fibres from which several mathematical models are constructed to explain electro-structural interactions of fibres with organic liquids. A balance between the elastic and surface energies of the CNT bundle network in different media allows the determination of the maximum lengths that open junctions can sustain before collapsing to minimize the surface energy. This characteristic length correlates well with the increase of fibre resistance upon immersion in organic liquids. We also study the effect of charge accumulation in open interbundle junctions and derive expressions to describe experimental data on the non-ohmic electrical behaviour of fibres immersed in polar liquids. Our analyses suggest that the non-ohmic behaviour is caused by progressively shorter junctions collapsing as the voltage is increased. Since our models are not based on any property unique to carbon nanotubes, they should also be useful to describe other hierarchical structures.

  5. New metal-organic nanomaterials synthesized by laser irradiation of organic liquids

    SciTech Connect

    Kuzmin, Stanislav L.; Wesolowski, Michal J.; Duley, Walter W.

    2014-03-31

    A new type of metal-organic composition consisting of clusters of nanoparticles has been synthesised by laser irradiation of metallocene/benzene solutions. The metallocene molecules in this reaction become the source of the metal. Exposure to high-energy femtosecond laser pulses dehydrogenate benzene molecules and initiate the high-temperature high-pressure conditions that results in the synthesis of new materials. Irradiation experiments have been carried out on ferrocene/benzene and on other solutions. With ferrocene the synthesis of a new compound has been confirmed by X-ray powder diffraction as the peaks detected do not correspond to any known substance in the Crystallography Open Database. Theoretical simulation of the periodic structure of this new carbide predicts that it has hexagonal symmetry and a unit cell with a = 3.2A and c =2.8A. The exact structure is still uncertain but may be determined from scanning tunneling microscope (STM) studies.

  6. Direct Observation of Self-Organized Water-Containing Structures in the Liquid Phase and Their Influence on 5-(Hydroxymethyl)furfural Formation in Ionic Liquids.

    PubMed

    Kashin, Alexey S; Galkin, Konstantin I; Khokhlova, Elena A; Ananikov, Valentine P

    2016-02-01

    Water-containing organic solutions are widespread reaction media in organic synthesis and catalysis. This type of multicomponent liquid system has a number of unique properties because of the tendency for water to self-organize in mixtures with other liquids. The characterization of these water domains is a challenging task because of their soft and dynamic nature. In the present study, the morphology and dynamics of micrometer- and nanometer-scale water-containing compartments in ionic liquids were directly observed by electron microscopy. A variety of morphologies, including isolated droplets, dense structures, aggregates, and 2D meshworks, have been experimentally detected and studied. Using the developed method, the impact of water on the acid-catalyzed biomass conversion reaction was studied at the microscopic level. The process that produced nanostructured domains in solution led to better yields and higher selectivities compared with reactions involving the bulk system. PMID:26754786

  7. LABORATORY INVESTIGATION OF RESIDUAL LIQUID ORGANICS FROM SPILLS, LEAKS, AND THE DISPOSAL OF HAZARDOUS WASTES IN GROUNDWATER

    EPA Science Inventory

    Organic liquids that are essentially immiscible with water migrate through the subsurface through the influence of capillary, viscous and buoyancy forces. Four experimental methods were employed. First, quantitative displacement experiments using short soil columns; second, add...

  8. LABORATORY INVESTIGATION OF RESIDUAL LIQUID ORGANICS FROM SPILLS, LEAKS, AND THE DISPOSAL OF HAZARDOUS WASTES IN GROUNDWATER

    EPA Science Inventory

    Organic liquids that are essentially immiscible with water migrate through the subsurface through the influence of capillary, viscous and buoyancy forces. our experimental methods were employed. irst, quantitative displacement experiments using short soil columns; second, additio...

  9. Photogeneration and enhanced charge transport in aligned smectic liquid crystalline organic semiconductor

    NASA Astrophysics Data System (ADS)

    Paul, Sanjoy; Ellman, Brett; Tripathi, Suvagata; Twieg, Robert J.

    2015-10-01

    Liquid crystalline organic semiconductors are emerging candidates for applications in electronic and photonic devices. One of the most attractive aspects of such materials is the potential, in principle, to easily control and manipulate the molecular alignment of the semiconductor over large length scales. Here, we explore the consequences of alignment in a model smectic liquid crystalline semiconductor, and find that the photogeneration efficiency is a strong function of incident polarization in aligned samples. A straightforward theory shows that such behavior is a general feature of aligned materials, regardless of the details of photophysics. Furthermore, we uncover tentative evidence that the mobility of aligned samples is substantially enhanced. Both of these phenomena are of significant technological importance.

  10. Photogeneration and enhanced charge transport in aligned smectic liquid crystalline organic semiconductor

    SciTech Connect

    Paul, Sanjoy; Ellman, Brett; Tripathi, Suvagata; Twieg, Robert J.

    2015-10-07

    Liquid crystalline organic semiconductors are emerging candidates for applications in electronic and photonic devices. One of the most attractive aspects of such materials is the potential, in principle, to easily control and manipulate the molecular alignment of the semiconductor over large length scales. Here, we explore the consequences of alignment in a model smectic liquid crystalline semiconductor, and find that the photogeneration efficiency is a strong function of incident polarization in aligned samples. A straightforward theory shows that such behavior is a general feature of aligned materials, regardless of the details of photophysics. Furthermore, we uncover tentative evidence that the mobility of aligned samples is substantially enhanced. Both of these phenomena are of significant technological importance.

  11. CO2-binding Organic Liquids, an Integrated Acid Gas Capture System

    SciTech Connect

    Heldebrant, David J; Koech, Phillip K; Rainbolt, James E; Zheng, Feng

    2011-04-01

    Amine systems are effective for CO2 capture, but they are still inefficient because the solvent regeneration energy is largely defined by the amount of water in the process. Most amines form heat-stable salts with SO2 and COS resulting in parasitic solvent loss and degradation. Stripping the CO2-rich solvent is energy intensive it requires temperatures above 100 °C due to the high specific heat and heat of vaporization of water. CO2-capture processes could be much more energy efficient in a water free amine process. In addition, if the capture-material is chemically compatible with other acid gases, less solvent would be lost to heat-stable salts and the process economics would be further improved. One such system that can address these concerns is Binding Organic Liquids (BOLs), a class of switchable ionic liquids.

  12. Nature-inspired light-harvesting liquid crystalline porphyrins for organic photovoltaics

    SciTech Connect

    Li, Lanfang; Kang, Shin-Woong; Harden, John; Sun, Qingjiang; Zhou, Xiaoli; Dai, Liming; Jakli, Antal; Kumar, Satyendra; Li, Quan

    2008-12-22

    A new class of nanoscale light-harvesting discotic liquid crystalline porphyrins, with the same basic structure of the best photoreceptor in nature (chlorophyll), was synthesized. These materials can be exceptionally aligned into a highly ordered architecture in which the columns formed by intermolecular {pi}-{pi} stacking are spontaneously perpendicular to the substrate. The homeotropic alignment, well confirmed by synchrotron X-ray diffraction, could not only provide the most efficient pathway for hole conduction along the columnar axis crossing the device thickness, but also offer the largest area to the incident light for optimized light harvesting. Their preliminary photocurrent generation and photovoltaic performances were also demonstrated. The results provide new and efficient pathways to the development of organic photovoltaics by using homeotropically aligned liquid crystal thin films.

  13. Aza-crown ether complex cation ionic liquids: preparation and applications in organic reactions.

    PubMed

    Song, Yingying; Cheng, Chen; Jing, Huanwang

    2014-09-26

    Aza-crown ether complex cation ionic liquids (aCECILs) were devised, fabricated, and characterized by using NMR spectroscopy, MS, thermogravimetric differential thermal analysis (TG-DTA), elemental analysis and physical properties. These new and room-temperature ILs were utilized as catalysts in various organic reactions, such as the cycloaddition reaction of CO2 to epoxides, esterification of acetic acid and alcohols, the condensation reaction of aniline and propylene carbonate, and Friedel-Crafts alkylation of indole with aldehydes were investigated carefully. In these reactions, the ionic liquid exhibited cooperative catalytic activity between the anion and cation. In addition, the aza-[18-C-6HK][HSO4]2 was the best acidic catalyst in the reactions of esterification and Friedel-Crafts alkylation under mild reaction conditions. PMID:25154312

  14. Self-organization processes and topological defects in nanolayers in a nematic liquid crystal

    SciTech Connect

    Chuvyrov, A. N.; Girfanova, F. M. Mal'tsev, I. S.

    2008-05-15

    Atomic force microscopy is used to study the self-organization processes that occur during the formation of topological defects in nanomolecular layers in a nematic liquid crystal with the homeotropic orientation of its molecules with respect to the substrate. In this case, a smectic monolayer with a thickness of one molecule length (about 2.2 nm) forms on the substrate, and a nanomolecular layer of a nematic liquid crystal forms above this monolayer. In such virtually two-dimensional layers, numerous different nanoclusters, namely, hut structures, pyramids, raft structures with symmetry C{sub nm} (where n = 2, 4, 5, 6, 7, ?, {infinity}), cones, and nanopools, form [1]. They have a regular shape close to the geometry of solid crystals. Modulated linear structures and topological point defects appear spontaneously in the nanopools and raft structures.

  15. Ionic liquid assisted hydrothermal fabrication of hierarchically organized γ-AlOOH hollow sphere

    SciTech Connect

    Tang, Zhe; Liu, Yunqi; Li, Guangci; Hu, Xiaofu; Liu, Chenguang

    2012-11-15

    Highlights: ► The γ-AlOOH hollow spheres were synthesized via an ionic liquid-assisted hydrothermal treatment. ► Ionic liquid plays an important role in the morphology of the product. ► Ionic liquid can be easily removed from the product and reused in next experiment. ► A “aggregation–solution–recrystallization” formation mechanism may occur in the system. -- Abstract: Hierarchically organized γ-AlOOH hollow spheres with nanoflake-like porous surface texture have been successfully synthesized via an ionic liquid-assisted hydrothermal synthesis method in citric acid monohydrate (CAMs). It was found that ionic liquid [bmim]{sup +}Cl{sup −} played an important role in the morphology of the product due to its strong interactions with reaction particles. The samples were characterized by X-ray Diffraction (XRD), Fourier Transform Infrared Spectroscopy (FT-IR), Scanning Electron Microscope (SEM) and Transmission Electron Microscopy (TEM). The results show that the product has narrow particle size distribution (500–900 nm particle diameter range), high specific surface area (240.5 m{sup 2}/g) and large pore volume (0.61 cm{sup 3}/g). The corresponding γ-Al{sub 2}O{sub 3} hollow spheres can be obtained by calcining it at 550 °C for 3 h. The proposed formation mechanism and other influencing factors of the γ-AlOOH hollow sphere material, such as reaction temperature, reaction duration, CAMs and urea, have also been investigated.

  16. Study of nanostructural organization of ionic liquids by electron paramagnetic resonance spectroscopy.

    PubMed

    Merunka, Dalibor; Peric, Mirna; Peric, Miroslav

    2015-02-19

    The X-band electron paramagnetic resonance spectroscopy (EPR) of a stable, spherical nitroxide spin probe, perdeuterated 2,2,6,6-tetramethyl-4-oxopiperidine-1-oxyl (pDTO) has been used to study the nanostructural organization of a series of 1-alkyl-3-methylimidazolium tetrafluoroborate ionic liquids (ILs) with alkyl chain lengths from two to eight carbons. By employing nonlinear least-squares fitting of the EPR spectra, we have obtained values of the rotational correlation time and hyperfine coupling splitting of pDTO to high precision. The rotational correlation time of pDTO in ILs and squalane, a viscous alkane, can be fit very well to a power law functionality with a singular temperature, which often describes a number of physical quantities measured in supercooled liquids. The viscosity of the ILs and squalane, taken from the literature, can also be fit to the same power law expression, which means that the rotational correlation times and the ionic liquid viscosities have similar functional dependence on temperature. The apparent activation energy of both the rotational correlation time of pDTO and the viscous flow of ILs and squalane increases with decreasing temperature; in other words, they exhibit strong non-Arrhenius behavior. The rotational correlation time of pDTO as a function of η/T, where η is the shear viscosity and T is the temperature, is well described by the Stokes-Einstein-Debye (SED) law, while the hydrodynamic probe radii are solvent dependent and are smaller than the geometric radius of the probe. The temperature dependence of hyperfine coupling splitting is the same in all four ionic liquids. The value of the hyperfine coupling splitting starts decreasing with increasing alkyl chain length in the ionic liquids in which the number of carbons in the alkyl chain is greater than four. This decrease together with the decrease in the hydrodynamic radius of the probe indicates a possible existence of nonpolar nanodomains. PMID:25594422

  17. Self-organization of jets in electrospinning from free liquid surface: A generalized approach

    NASA Astrophysics Data System (ADS)

    Lukas, David; Sarkar, Arindam; Pokorny, Pavel

    2008-04-01

    Electrospinning has enabled creation of excellent materials for a great number of applications. Previously, it was based on less productive capillary spinners. The present study is based on recent efforts to elevate electrospinning technology to an industrial level by simultaneously provoking innumerable polymeric jets from a sufficiently large liquid surface to increase productivity. Particularly, it deals with electrospinning from free surface of conductive liquids and validates a formulated hypothesis that explains self-organization of jets on one-dimensional free liquid surfaces in terms of electrohydrodynamic instability of surface waves. Here, it is shown how the hypothesis, based on a profound analysis of a dispersion law, explains that above a certain critical value of applied electric field intensity/field strength the system starts to be self-organized in mesocopic scale due to the mechanism of the "fastest forming instability." The mechanism plays a key role in selecting a particular wave with a characteristic wavelength whose amplitude boundlessly grows faster than the others. The fastest growing stationary wave, according to the hypothesis, marks the onset of electrospinning from a free liquid surface with its jets originating from the wave crests. Singularity of this approach lies in predicting critical values of the phenomenon, viz., critical field strength and corresponding critical interjet distance. The critical field strength, will, thereafter, be used in defining a unique dimensionless electrospinning number. It will, subsequently, be shown how the critical interjet distance, i.e., the maximal distance between the neighboring jets, simply depends on the capillary length. The capillary length represents a latent characteristic spatial scale of the system. The theory also predicts interjet distance for field strengths above the critical value. The said prediction is universally applicable for all conductive liquids if it is expressed in terms of

  18. Organics Produced by Irradiation of Frozen and Liquid HCN Solutions: Implications for Chemical Evolution Studies

    NASA Astrophysics Data System (ADS)

    Colín-García, M.; Negrón-Mendoza, A.; Ramos-Bernal, S.

    2009-04-01

    Hydrogen cyanide (HCN), an important precursor of organic compounds, is widely present in extraterrestrial environments. HCN is also readily synthesized in prebiotic simulation experiments. To gain insight into the radiation chemistry of one of the most important and highly versatile constituents of cometary ices, we examined the behavior of over-irradiated frozen and liquid HCN solutions under ionizing radiation. The samples were exposed to gamma radiation at a dose range from 0 up to 419 kGy. Ultraviolet spectroscopy and gas chromatography were used to follow the process. The analyses confirmed that gamma-ray irradiation of liquid HCN solutions generates several organic products. Many of them are essential to life; we verified the presence of carboxylic acids (some of them members of the Krebs cycle) as well as free amino acids and urea. These are the first studies to reveal the presence of these compounds in experiments performed at low temperatures and bulk irradiation. Organic material was produced even at low temperatures and low radiation doses. This work strongly supports the presumption that, as a parent molecule, HCN played a central essential role in the process of chemical evolution on early Earth, comets, and other extraterrestrial environments.

  19. Liquid- and Ice-Phase Kinetics of Singlet Molecular Oxygen with Organic Pollutants

    NASA Astrophysics Data System (ADS)

    Bower, J. P.; Anastasio, C.

    2012-12-01

    Singlet molecular oxygen (1O2*), a reactive state of dissolved oxygen, is formed from a sensitizer chromophore that absorbs light and transfers energy to ground-state O2. The chemistry of 1O2* has been studied predominantly in surface waters and aqueous atmospheric drops, where 1O2* can be an important sink for electron-rich pollutants. In our recent work we have shown that 1O2* concentrations can be enhanced by several orders of magnitude on ice compared to in identical, but unfrozen, aqueous solutions. The goal of this work is to assess the potential importance of 1O2* to the decay of organic pollutants on ice in order to better understand pollutant cycling in the cryosphere. Using 549 nm radiation we illuminated liquid and bulk ice samples containing a 1O2* sensitizer (Rose Bengal), salt (NaCl), and an organic pollutant at a controlled temperature. Organic species were chosen to represent several chemical classes, including furans (furfuryl alcohol), phenols (bisphenol A), and amino acids (tryptophan). During illumination the decay of the pollutant was measured to determine the rate constant for loss by reaction with 1O2*. In all cases we observe enhanced loss of pollutants on ice relative to liquid samples. We will discuss how the magnitude of the ice-phase enhancement depends on the different pollutant classes, their aqueous solubility, and freezing point depression.

  20. Spatially resolved charge transport study in discotic liquid crystalline organic semiconductors

    NASA Astrophysics Data System (ADS)

    Paul, Sanjoy; Semyonov, Alexander; Dawson, Nathan J.; Singer, Kenneth D.; Twieg, Robert J.; Ellman, Brett

    Spatially resolved time-of-flight photogeneration and mobility have been measured on a discotic liquid crystalline organic semiconductor using scanning time-of-flight microscopy (STOFm). STOFm simultaneously obtains time-of-flight transients and polarized transmittance across the sample. Various shapes in time-of-flight transients were observed and extracted charge transport parameters such as photogeneration efficiency, mobility, and trapping show significant spatial variation. In some cases these can be linked to electrode surface inhomogeneities. Detailed measurement methodology, experimental results and challenges in their analysis will be discussed.

  1. One-step synthesis of layered yttrium hydroxides in immiscible liquid-liquid systems: Intercalation of sterically-bulky hydrophobic organic anions and doping of europium ions

    NASA Astrophysics Data System (ADS)

    Watanabe, Mebae; Fujihara, Shinobu

    2014-02-01

    Inorganic-organic layered rare-earth compounds were synthesized on the basis of a biphasic liquid-liquid system in one pot. Layered yttrium hydroxides (LYHs) were chosen as a host material for the intercalation of hydrophobic organic guest anions such as benzoate, sebacate, or laurate. In a typical synthesis, an organic phase dissolving carboxylic acid was placed in contact with an equal amount of an aqueous phase dissolving yttrium nitrate n-hydrate and urea. At elevated temperatures up to 80 °C, urea was hydrolyzed to release hydroxyl anions which were used to form yttrium hydroxide layers. LYHs were then precipitated with the intercalation of carboxylate anions delivered from the organic phase under the distribution law. The structure and the morphology of the LYHs could be modulated by the intercalated anions. Doped with Eu3+ ions, the LYHs exhibited red photoluminescence which was enhanced by the intercalated anions due to the antenna effect.

  2. Aqueous liquid feed organic fuel cell using solid polymer electrolyte membrane

    NASA Technical Reports Server (NTRS)

    Surampudi, Subbarao (Inventor); Narayanan, Sekharipuram R. (Inventor); Vamos, Eugene (Inventor); Frank, Harvey A. (Inventor); Halpert, Gerald (Inventor); Olah, George A. (Inventor); Prakash, G. K. Surya (Inventor)

    1997-01-01

    A liquid organic fuel cell is provided which employs a solid electrolyte membrane. An organic fuel, such as a methanol/water mixture, is circulated past an anode of a cell while oxygen or air is circulated past a cathode of the cell. The cell solid electrolyte membrane is preferably fabricated from Nafion.TM.. Additionally, a method for improving the performance of carbon electrode structures for use in organic fuel cells is provided wherein a high surface-area carbon particle/Teflon.TM.-binder structure is immersed within a Nafion.TM./methanol bath to impregnate the electrode with Nafion.TM.. A method for fabricating an anode for use in a organic fuel cell is described wherein metal alloys are deposited onto the electrode in an electro-deposition solution containing perfluorooctanesulfonic acid. A fuel additive containing perfluorooctanesulfonic acid for use with fuel cells employing a sulfuric acid electrolyte is also disclosed. New organic fuels, namely, trimethoxymethane, dimethoxymethane, and trioxane are also described for use with either conventional or improved fuel cells.

  3. Nondisruptive Dissolution of Hyperpolarized (129)Xe into Viscous Aqueous and Organic Liquid Crystalline Environments.

    PubMed

    Truxal, Ashley E; Slack, Clancy C; Gomes, Muller D; Vassiliou, Christophoros C; Wemmer, David E; Pines, Alexander

    2016-04-01

    Studies of hyperpolarized xenon-129 (hp-(129)Xe) in media such as liquid crystals and cell suspensions are in demand for applications ranging from biomedical imaging to materials engineering but have been hindered by the inability to bubble Xe through the desired media as a result of viscosity or perturbations caused by bubbles. Herein a device is reported that can be reliably used to dissolve hp-(129)Xe into viscous aqueous and organic samples without bubbling. This method is robust, requires small sample volumes (<60 μL), is compatible with existing NMR hardware, and is made from readily available materials. Experiments show that Xe can be introduced into viscous and aligned media without disrupting molecular order. We detected dissolved xenon in an aqueous liquid crystal that is disrupted by the shear forces of bubbling, and we observed liquid-crystal phase transitions in (MBBA). This tool allows an entirely new class of samples to be investigated by hyperpolarized-gas NMR spectroscopy. PMID:26954536

  4. Mass transfer from nonaqueous phase organic liquids in water-saturated porous media

    SciTech Connect

    Geller, J.T. ); Hunt, J.R. )

    1993-04-01

    The widespread production and use of industrial solvents and liquid petroleum products have provided ample opportunity for subsurface contamination from leaking underground storage tanks and pipelines, hazardous waste sites, and surface spills. The aqueous solubility of these organic liquid contaminants is low enough for them to exist in the subsurface as nonaqueous phase liquids (NAPLs) but large enough to seriously degrade water quality. In this paper, results from measuring the complete dissolution of trapped NAPLs and developing a model are discussed. The NAPL saturation is modeled as discrete spheres that are initially uniform in size. From the experimental data, ganglia size and the cross-sectional area of the NAPL region are obtained by fitting the model to the data and assuming a fixed initial NAPL saturation. This two-parameter model, when combined with known magnitudes of residual saturation and relative permeability functions represented experimental observations of (1) increasing aqueous concentration during initial water flooding as the mass transfer zone is established, (2) a quasi-steady effluent concentration as the mass transfer zone propagates downstream, and (3) the decline in effluent concentration as the NAPL-containing region shrinks to less than the length of the mass transfer zone. The experimental data and modeling effort illustrate mechanisms that limit the remediation of NAPL-contaminated aquifers. There is a complex dependency of groundwater contaminant concentration on flow velocity.

  5. OPTIMIZED DETERMINATION OF TRACE JET FUEL VOLATILE ORGANIC COMPOUNDS IN HUMAN BLOOD USING IN-FIELD LIQUID-LIQUID EXTRACTION WITH SUBSEQUENT LABORATORY GAS CHROMATOGRAPHIC-MASS SPECTROMETRIC ANALYSIS AND ON-COLUMN LARGE VOLUME INJECTION

    EPA Science Inventory

    A practical and sensitive method to assess volatile organic compounds (VOCs) from JP-8 jet fuel in human whole blood was developed by modifying previously established liquid-liquid extraction procedures, optimizing extraction times, solvent volume, specific sample processing te...

  6. Marangoni Convection in Evaporating Organic Liquid Droplets on a Nonwetting Substrate.

    PubMed

    Chandramohan, Aditya; Dash, Susmita; Weibel, Justin A; Chen, Xuemei; Garimella, Suresh V

    2016-05-17

    We quantitatively characterize the flow field inside organic liquid droplets evaporating on a nonwetting substrate. A mushroom-structured surface yields the desired nonwetting behavior with methanol droplets, while use of a cooled substrate (5-15 °C) slows the rate of evaporation to allow quasi-static particle image velocimetry. Visualization reveals a toroidal vortex within the droplet that is characteristic of surface tension-driven flow; we demonstrate by means of a scaling analysis that this recirculating flow is Marangoni convection. The velocities in the droplet are on the order of 10-45 mm/s. Thus, unlike in the case of evaporation on wetting substrates where Marangoni convection can be ignored for the purpose of estimating the evaporation rate, advection due to the surface tension-driven flow plays a dominant role in the heat transfer within an evaporating droplet on a nonwetting substrate because of the large height-to-radius aspect ratio of the droplet. We formulate a reduced-order model that includes advective transport within the droplet for prediction of organic liquid droplet evaporation on a nonwetting substrate and confirm that the predicted temperature differential across the height of the droplet matches experiments. PMID:27119436

  7. Evaluating the Molecular Interaction of Organic Liquid Mixtures Using Near-Infrared Spectroscopy.

    PubMed

    Xiong, Zhixin; Pfeifer, Frank; Siesler, Heinz W

    2016-04-01

    The near-infrared transmission spectra of two organic liquid three-component systems of variable compositions were investigated in detail. To evaluate the interaction of the different components in the two systems the experimental spectra of the pure components were compared to mathematically constructed "pure component" spectra. Though usually the correlation coefficient (CC) and Manhattan distance (MD) are used to measure the similarity of spectra, in the present investigations principal component analysis (PCA) was found to be a more effective tool to investigate the difference between these spectra and derive parameters characterizing the interaction between the different components. Thus, PC scores for the two types of spectra established some distinct patterns which clearly expressed their differences. For a three-dimensional coordinate system of selected principal components, the Euclidean distances between the mathematically constructed and the experimental spectra of the pure components were calculated. Finally, the mean values of the distances for each component provided indices to rank the interaction of the components in the mixtures. Thus, the results offer a convenient approach that can quantitatively evaluate the molecular interactions of the individual components in organic liquid mixtures by various spectroscopies. PMID:26928223

  8. Investigation of three-dimensional localisation of radioactive sources using a fast organic liquid scintillator detector

    NASA Astrophysics Data System (ADS)

    Gamage, K. A. A.; Joyce, M. J.; Taylor, G. C.

    2013-04-01

    In this paper we discuss the possibility of locating radioactive sources in space using a scanning-based method, relative to the three-dimensional location of the detector. The scanning system comprises an organic liquid scintillator detector, a tungsten collimator and an adjustable equatorial mount. The detector output is connected to a bespoke fast digitiser (Hybrid Instruments Ltd., UK) which streams digital samples to a personal computer. A radioactive source has been attached to a vertical wall and the data have been collected in two stages. In the first case, the scanning system was placed a couple of metres away from the wall and in the second case it moved few centimetres from the previous location, parallel to the wall. In each case data were collected from a grid of measurement points (set of azimuth angles for set of elevation angles) which covered the source on the wall. The discrimination of fast neutrons and gamma rays, detected by the organic liquid scintillator detector, is carried out on the basis of pulse gradient analysis. Images are then produced in terms of the angular distribution of events for total counts, gamma rays and neutrons for both cases. The three-dimensional location of the neutron source can be obtained by considering the relative separation of the centres of the corresponding images of angular distribution of events. The measurements have been made at the National Physical Laboratory, Teddington, Middlesex, UK.

  9. Macrophages Sequester Clofazimine in an Intracellular Liquid Crystal-Like Supramolecular Organization

    PubMed Central

    Baik, Jason; Rosania, Gus R.

    2012-01-01

    Clofazimine is a poorly-soluble but orally-bioavailable small molecule drug that massively accumulates in macrophages when administered over prolonged periods of time. To determine whether crystal-like drug inclusions (CLDIs) that form in subcellular spaces correspond to pure clofazimine crystals, macrophages of clofazimine-fed mice were elicited with an intraperitoneal thioglycollate injection. Inside these cells, CLDIs appeared uniform in size and shape, but were sensitive to illumination. Once removed from cells, CLDIs were unstable. Unlike pure clofazimine crystals, isolated CLDIs placed in distilled water burst into small birefringent globules, which aggregated into larger clusters. Also unlike pure clofazimine crystals, CLDIs fragmented when heated, and disintegrated in alkaline media. In contrast to all other organelles, CLDIs were relatively resistant to sonication and trypsin digestion, which facilitated their biochemical isolation. The powder x-ray diffraction pattern obtained from isolated CLDIs was consistent with the diffraction pattern of liquid crystals and inconsistent with the expected molecular diffraction pattern of solid, three dimensional crystals. Observed with the transmission electron microscope (TEM), CLDIs were bounded by an atypical double-layered membrane, approximately 20 nanometers thick. CLDIs were polymorphic, but generally exhibited an internal multilayered organization, comprised of stacks of membranes 5 to 15 nanometers thick. Deep-etch, freeze-fracture electron microscopy of unfixed snap-frozen tissue samples confirmed this supramolecular organization. These results suggest that clofazimine accumulates in macrophages by forming a membrane-bound, multilayered, liquid crystal-like, semi-synthetic cytoplasmic structure. PMID:23071814

  10. Organic solvents for pharmaceutical parenterals and embolic liquids: a review of toxicity data.

    PubMed

    Mottu, F; Laurent, A; Rufenacht, D A; Doelker, E

    2000-01-01

    Non-aqueous solvents have long been used in subcutaneous or intramuscular pharmaceutical formulations to dissolve water-insoluble drugs. In recent years, the need for these vehicles was increased since the drug discovery process has yielded many poorly water-soluble drugs. Besides, preparations containing embolic materials dissolved in undiluted non-aqueous water-miscible solvents have been proposed for the intravascular treatment of aneurysms, arteriovenous malformations, or tumors. These organic solvents, regarded as chemically and biologically inert, may show pharmacological and toxicological effects. Therefore, knowledge of tolerance and activity of non-aqueous solvents is essential before they can be administered, especially when given undiluted. This paper focuses on thirteen organic solvents reported as possible vehicles for injectable products and details toxicological data when they have been administered intravascularly. These solvents can be subdivided into three groups according to their description in the literature either for intravenous pharmaceutical parenterals or for intravascular embolic liquids: well-documented organic solvents (propylene glycol, polyethylene glycols, ethanol), solvents described in specific applications (dimethyl sulfoxide, N-methyl-2-pyrrolidone, glycofurol, Solketal, glycerol formal, acetone), and solvents not reported in intravascular applications but potentially useful (tetrahydrofurfuryl alcohol, diglyme, dimethyl isosorbide, ethyl lactate). This review of the literature shows that toxicity data on intravascular organic solvents are insufficient because they concern solvents diluted with water and because of the lack of comparative evaluation using the same methodologies. PMID:11107838

  11. Liquid-phase adsorption of organic compounds by granular activated carbon and activated carbon fibers

    SciTech Connect

    Lin, S.H.; Hsu, F.M.

    1995-06-01

    Liquid-phase adsorption of organic compounds by granular activated carbon (GAC) and activated carbon fibers (ACFs) is investigated. Acetone, isopropyl alcohol (IPA), phenol, and tetrahydrofuran (THF) were employed as the model compounds for the present study. It is observed from the experimental results that adsorption of organic compounds by GAC and ACF is influenced by the BET (Brunauer-Emmett-Teller) surface area of adsorbent and the molecular weight, polarity, and solubility of the adsorbate. The adsorption characteristics of GAC and ACFs were found to differ rather significantly. In terms of the adsorption capacity of organic compounds, the time to reach equilibrium adsorption, and the time for complete desorption, ACFs have been observed to be considerably better than GAC. For the organic compounds tested here, the GAC adsorptions were shown to be represented well by the Langmuir isotherm while the ACF adsorption could be adequately described by the Langmuir or the Freundlich isotherm. Column adsorption tests indicated that the exhausted ACFs can be effectively regenerated by static in situ thermal desorption at 150 C, but the same regeneration conditions do not do as well for the exhausted GAC.

  12. Organic solvents induce the formation of oil-in-ionic liquid microemulsion aggregations.

    PubMed

    Gao, Yanan; Li, Na; Zhang, Shaohua; Zheng, Liqiang; Li, Xinwei; Dong, Bin; Yu, Li

    2009-02-01

    The role of four organic solvents in the formation process of 1-butyl-3-methylimidazolium tetrafluoroborate (bmimBF4) based ionic liquid (IL) microemulsions is investigated. The results showed that the addition of Triton X-100 remarkably decreased the conductivity of bmimBF4. The added organic solvents provided a strong apolar environment for the hydrophobic tails of Triton X-100 and caused the surfactant molecules to aggregate into the interfacial film of oil-in-bmimBF4 (O/IL) microemulsions. As a result, the conductivities of the solutions were initially increased because the insulative Triton X-100 molecules were assembled, which corresponded to increasing the concentration of continuous bmimBF4 solutions. The hydrophobic interaction between the dispersed organic solvents and the hydrophobic tails of Triton X-100 may be the driving force for the formation of O/IL microemulsions. The droplets of O/IL microemulsions were successively swollen by organic solvents, and a bicontinuous IL-containing microemulsion was observed by freeze-fracture transmission electron microscopy for the first time. The current study can help in further understanding the ILs-containing microemulsions and thereby improve microemulsion theory. PMID:19138136

  13. A reversible zwitterionic SO2-binding organic liquid

    SciTech Connect

    Heldebrant, David J; Koech, Phillip K; Yonker, Clement R

    2010-01-05

    As fossil fuel consumption continues, there is much attention being focused on capturing acid gas emissions from power plants. We have recently investigated SO2-binding organic liquids (SO2BOLs) as means to reversibly capture and release SO2 selectively over CO2.1 SO2BOLs are mixtures of tertiary amines and alcohols, which bind SO2 as liquid ammonium alkylsulfite salts. Tertiary amines selectively bind SO2 over CO2 because tertiary amines are basic enough to accept a proton from sulfurous and alkylsulfurous acids but not carbonic or alkylcarbonic acids. This is in contrast to other groups who absorb SO2 physically in ionic liquids2-4 or chemically absorb SO2 in organic systems5-7 or as irreversible aqueous bisulfite or sulfite salts.8-11 Our dual component SO2BOL ionic liquids can contain up to 47% SO2 by mass, have low specific heats, and can be desulfoxylated by heating to 90ºC.1 We believed that a bifunctional tertiary alkanol amine would be able to capture SO2 comparable to our binary SO2BOL system. We present here the first reversible zwitterionic liquid produced from the reaction of SO2 with N,N-dibutylundecanolamine (DBUA). The SO2 is chemically bound through the alcohol moiety as an alkylsulfite, which we believe is stabilized by hydrogen bonding through the protonated amine portion of the molecule. Our recent interest in SO2BOLs led us to explore the possible reaction of aprotic alkanolamines with SO2 to form single-component SO2BOLs. A symbiotic pairing of the base and the alcohol on one molecule allows for a simple unimolecular system compared to the binary SO2BOL system. The bifunctional molecule also would have reduced volatility compared to tertiary amines due to increased hydrogen bonding from the alcohol moiety. To our knowledge

  14. Observations and implications of liquid-liquid phase separation at high relative humidities in secondary organic material produced by α-pinene ozonolysis without inorganic salts

    NASA Astrophysics Data System (ADS)

    Renbaum-Wolff, L.; Song, M.; Marcolli, C.; Zhang, Y.; Liu, P. F.; Grayson, J. W.; Geiger, F. M.; Martin, S. T.; Bertram, A. K.

    2015-11-01

    Particles consisting of secondary organic material (SOM) are abundant in the atmosphere. To predict the role of these particles in climate, visibility, and atmospheric chemistry, information on particle phase state (i.e. single liquid, two liquids, solid and so forth) is needed. This paper focuses on the phase state of SOM particles free of inorganic salts produced by the ozonolysis of α-pinene. Phase transitions were investigated both in the laboratory and with a thermodynamic model over the range of < 0.5 % to 100 % relative humidity (RH) at 290 K. In the laboratory studies, a single phase was observed from 0 to 95 % RH while two liquid phases were observed above 95 % RH. For increasing RH, the mechanism of liquid-liquid phase separation (LLPS) was spinodal decomposition. The RH range at which two liquid phases were observed did not depend on the direction of RH change. In the modelling studies at low RH values, the SOM took up hardly any water and was a single organic-rich phase. At high RH values, the SOM underwent LLPS to form an organic-rich phase and an aqueous phase, consistent with the laboratory studies. The presence of LLPS at high RH-values has consequences for the cloud condensation nuclei (CCN) activity of SOM particles. In the simulated Köhler curves for SOM particles, two local maxima are observed. Depending on the composition of the SOM, the first or second maximum can determine the critical supersaturation for activation. The presence of LLPS at high RH-values can explain inconsistencies between measured CCN properties of SOM particles and hygroscopic growth measured below water saturation.

  15. Fluorescent and Electroactive Low-Viscosity Tetrazine-Based Organic Liquids.

    PubMed

    Allain, Clémence; Piard, Jonathan; Brosseau, Arnaud; Han, Madeleine; Paquier, Julien; Marchandier, Thomas; Lequeux, Médéric; Boissière, Cédric; Audebert, Pierre

    2016-08-10

    New fluorescent molecular liquids with a tetrazine core have been prepared. These compounds remain liquid at least down to -60 °C and display very low viscosities (28 mPa.s for liquid 1, 58 mPa.s for liquid 2). Both compounds remain fluorescent in the condensed phase. For liquid 1, intermolecular quenching is observed to a certain extent, whereas liquid 2 displays similar photophysical properties in dilute solution and in neat film. PMID:27434378

  16. Assessment of dispersive liquid-liquid microextraction conditions for gas chromatography time-of-flight mass spectrometry identification of organic compounds in honey.

    PubMed

    Moniruzzaman, M; Rodríguez, I; Rodríguez-Cabo, T; Cela, R; Sulaiman, S A; Gan, S H

    2014-11-14

    The suitability of the dispersive liquid-liquid microextraction (DLLME) technique for gas chromatography (GC) characterization of minor organic compounds in honey samples is evaluated. Under optimized conditions, samples were pre-treated by liquid-liquid extraction with acetonitrile followed by DLLME using carbon tetrachloride (CCl4, 0.075 mL) as extractant. The yielded settled phase was analyzed by GC using high resolution time-of-flight (TOF) mass spectrometry (MS). The whole sample preparation process is completed in approximately 10 min, with a total consumption of organic solvents below 4 mL, relative standard deviations lower than 12% and with more than 70 organic compounds, displaying linear retention index in the range from 990 to 2900, identified in the obtained extracts. In comparison with HS SPME extraction, higher peak intensities were attained for most volatile and semi-volatile compounds amenable to both extraction techniques. Furthermore, other species such as highly polar and water soluble benzene acids, long chain fatty acids, esters and flavonoids, which are difficult to concentrate by HS SPME, could be identified in DLLME extracts. Some of the compounds identified in DLLME extracts have been proposed as useful for samples classification and/or they are recognized as markers of honeys from certain geographic areas. PMID:25441341

  17. A General Strategy for the Separation of Immiscible Organic Liquids by Manipulating the Surface Tensions of Nanofibrous Membranes.

    PubMed

    Wang, Li; Zhao, Yong; Tian, Ye; Jiang, Lei

    2015-12-01

    Oil/water separation membranes with different wettability towards water are attractive for their economic efficiency and convenience. The key factor for the separation process is the roughness-enhanced wettability of membranes based on the intrinsic wetting threshold (IWT) of water, that is, the limitation of the wettability caused by hydrophobicity and hydrophilicity. However, the separation of organic liquids (OLs) remains a challenge. Herein, we manipulate the surface tensions of nanofibrous membranes to lie between the IWTs of the two OLs to be separated so that the nanofibrous membranes can be endowed with superlyophobicity and superlyophilicity for the two liquids, and thus lead to successful separation. Our investigations provide a general strategy to separate any immiscible liquids efficiently, and may lead to the development of membranes with a large capacity, high flux, and high selectivity for organic reactions or liquid extraction in chemical engineering. PMID:26492856

  18. Focused ultrasound solid-liquid extraction for the determination of organic biomarkers in beachrocks.

    PubMed

    Blanco-Zubiaguirre, L; Arrieta, N; Iturregui, A; Martinez-Arkarazo, I; Olivares, M; Castro, K; Olazabal, M A; Madariaga, J M

    2015-11-01

    Beachrocks are consolidated coastal sedimentary formations resulting mainly from the relative rapid cementation of beach sediments by different calcium carbonate polymorphs. Although previous works have already studied the elemental composition and the mineral phases composing these cements, few of them have focused their attention on the organic matter present therein. This work describes an extraction methodology based on focused ultrasound solid-liquid extraction (FUSLE), followed by analysis using large volume injection (LVI) in a programmable temperature vaporizer (PTV) combined with gas chromatography-mass spectrometry (GC-MS) in order to determine organics such as polycyclic aromatic hydrocarbons (PAHs) and biomarkers (hopanes), which can increase and confirm the information obtained so far. This goal has been achieved after the optimization of the main parameters affecting the extraction procedure, such as, extraction solvent, FUSLE variables (amplitude, extraction time and pulse time) and also variables affecting the LVI-PTV (vent time, injection speed and cryo-focusing temperature). The developed method rendered results comparable to traditional extraction methods in terms of accuracy (77-109%) and repeatability (RSD<23%). Finally, the analyses performed over real beachrock samples from the Bay of Biscay (Northern Spain) revealed the presence of the 16 EPA priority PAHs, as well as some organic biomarkers which could increase the knowledge about such beachrock formation. PMID:26186864

  19. Towards safer sodium-ion batteries via organic solvent/ionic liquid based hybrid electrolytes

    NASA Astrophysics Data System (ADS)

    Monti, Damien; Ponrouch, Alexandre; Palacín, M. Rosa; Johansson, Patrik

    2016-08-01

    Hybrid electrolytes aimed at application in sodium-ion batteries (SIB) consisting of an organic solvent mixture (EC:PC) and different ionic liquids (ILs); EMImTFSI, BMImTFSI, and Pyr13TFSI, and with the NaTFSI salt providing the Na+ charge carriers have here been extensively studied. The physico-chemical and electrochemical characterisation includes ionic conductivity, viscosity, density, cation coordination and solvation, various safety measures, and electrochemical stability window (ESW). Hybrid electrolytes with 10-50% of IL content were found to have ionic conductivities on par with comparable organic solvent based electrolytes, but with highly enhanced safety properties. A systematic Raman spectroscopy study of the cation coordination and solvation before and after electrolyte safety tests by ignition suggest that IL cations and TFSI remain stable when ignited while organic solvents are consumed. Finally, the solid electrolyte interphase (SEI) formed when using hybrid electrolytes has both better mechanical and electrochemical stability than the SEI derived from pure IL based electrolytes. For a half-cell with a hard carbon (HC) electrode and a hybrid electrolyte with a composition of 0.8 m NaTFSI in EC0.45:PC0.45:Pyr13TFSI0.10 encouraging results were obtained for IL based electrolytes - ca. 182 mAhg-1 at C/10 over 40 cycles.

  20. Numerical studies on self-organized liquid crystal micro photonic systems

    NASA Astrophysics Data System (ADS)

    Matsui, Tatsunosuke; Kitaguchi, Masahiro; Okajima, Akiko

    2014-03-01

    The liquid crystals (LCs) form various types of nano- and micro- structures in a self-organized manner. In recent years, numerous studies have been carried out to develop novel types of optical functional materials and devices utilizing such self-organizing characteristics of the LCs. Based on the finite-difference time-domain (FDTD) method or its extended version, auxiliary differential equation FDTD (ADE-FDTD) method, we have been numerically studying on the optical characteristics and functionalities of the self-organized LCs such as: (1) lasing from the cholesteric LCs (CLCs) and (2) photonic nanojet (PNJ) from LC micro-systems. Based on the ADE-FDTD method incorporating the equation of motion of the macroscopic polarization and the rate equations at the four level energy structures, we have successfully reproduced circularly polarized lasing from CLC at the edge energy of the stop band. It has also been clarified that the introduction of the defect is effective to lower the lasing threshold. Our technique can be utilized to design the CLC laser devise architecture for much lowered lasing threshold. The PNJ from LC micro-systems are uniquely polarized reflecting birefringence of LCs, which cannot be obtained using optically isotropic microdroplets or microcylinders. A small degree of birefringence drastically changes the optical characteristics of the obtained PNJ. Our findings may open the way for the development of the novel optical functional materials and devices.

  1. Interfacial spreading effects on one-dimensional organic liquid imbibition in water-wetted porous media

    NASA Astrophysics Data System (ADS)

    McBride, J. F.; Simmons, C. S.; Cary, J. W.

    1992-10-01

    The spreading coefficient, Csp, determines whether an organic immiscible liquid, OIL, will form a lens ( Csp < 0) or will spread spontaneously ( Csp > 0) on a water surface. An OIL that forms a lens does not perfectly wet the water surface and therefore has a contact angle greater than 0°. The one-dimensional rate at which an OIL spreads spontaneously on a water surface is proportional to the square root of Csp. Of the OIL's that pose a contaminant threat to the subsurface, the majority has a non-zero Csp. To test the influence of such interfacial spreading phenomena on OIL infiltration in a pristine vadose zone, upward OIL and water imbibition infiltration experiments were performed in glass-bead columns, moistened with water, by using OIL's with different Csp. An analytical model for saturated liquid front rise was used to inversely estimate the effective capillary pressure head at the front and the average liquid conductivity. A nonspreading OIL ( Csp ≪ 0) exhibited a reduced capillary pressure head in the water-wetted glass beads. A spontaneously spreading OIL ( Csp ≫0) manifested an enhanced capillary pressure head. Reduced capillary pressure head was associated with an increase in average conductivity, and enhanced capillary pressure head was associated with a decrease in average conductivity when compared to the average water conductivity during water imbibition. The employed experimental method and mathematical analysis of dynamic flow, subject to interfacial spreading phenomena, are practical for quantifying parameters for use in sharp-front OIL infiltration models, but more research is needed to determine how to incorporate the spreading coefficient in numerical multiphase flow models.

  2. Polarization-Sensitive Two-Photon Microscopy Study of the Organization of Liquid-Crystalline DNA

    PubMed Central

    Mojzisova, Halina; Olesiak, Joanna; Zielinski, Marcin; Matczyszyn, Katarzyna; Chauvat, Dominique; Zyss, Joseph

    2009-01-01

    Abstract Highly concentrated DNA solutions exhibit self-ordering properties such as the generation of liquid-crystalline phases. Such organized domains may play an important role in the global chromatin topology but can also be used as a simple model for the study of more complex 3D DNA structures. In this work, using polarized two-photon fluorescence microscopy, we report on the orientation of DNA molecules in liquid-crystalline phases. For this purpose, we analyze the signal emitted by fluorophores that are noncovalently bound to DNA strands. In nonlinear processes, excitation occurs exclusively in the focal volume, which offers advantages such as the reduction of photobleaching of out-of-focus molecules and intrinsic 3D sectioning capability. Propidium iodide and Hoechst, two fluorophores with different DNA binding modes, have been considered. Polarimetric measurements show that the dyes follow the alignment with respect to the DNA strands and allow the determination of the angles between the emission dipoles and the longitudinal axis of the DNA double strand. These results provide a useful starting point toward the application of two-photon polarimetry techniques to determine the local orientation of condensed DNA in physiological conditions. PMID:19843467

  3. Self-Assembly Directed Organization of Nanodiamond During Ionic Liquid Crystalline Polymer Formation.

    PubMed

    Ringstrand, Bryan S; Seifert, Sönke; Podlesak, David W; Firestone, Millicent A

    2016-07-01

    The UV-initiated free radical polymerization of a lyotropic mesophase prepared by co-assembly of an aqueous mixture of an ionic liquid (IL) monomer, 3-decyl-1-vinylimidazolium chloride, in a dimethyl sulfoxide dispersion of an IL-monomer nanodiamond conjugate yields a well-ordered 2D hexagonally structured network-polymer composite. The IL monomer is covalently bound to carboxylated detonation diamond via ester-linked 3-decyl-1-vinylimidazolium bromide. Successful preparation of the amphiphile-functionalized nanodiamond is determined by ATR/FT-IR, thermogravimetric analysis, and small-angle X-ray scattering (SAXS). Mesophase and composite structure are evaluated by SAXS, revealing a columnar architecture composed of amphiphilic ionic liquid cylinders containing solvent-rich cores. Self-assembly directed site localization of the nanodiamond positions the particles in the alkyl chain continuum upon polymerization. The composite reversibly swells in ethanol allowing structural variation and modulation of the nanoparticle internal packing arrangement. This work demonstrates that through careful molecular design, self-organization and site-directed assembly of nanodiamond into chemically distinct regions of a nanostructured organogel can be achieved. PMID:27197942

  4. Hybrid glasses from strong and fragile metal-organic framework liquids

    PubMed Central

    Bennett, Thomas D.; Tan, Jin-Chong; Yue, Yuanzheng; Baxter, Emma; Ducati, Caterina; Terrill, Nick J.; Yeung, Hamish H. -M.; Zhou, Zhongfu; Chen, Wenlin; Henke, Sebastian; Cheetham, Anthony K.; Greaves, G. Neville

    2015-01-01

    Hybrid glasses connect the emerging field of metal-organic frameworks (MOFs) with the glass formation, amorphization and melting processes of these chemically versatile systems. Though inorganic zeolites collapse around the glass transition and melt at higher temperatures, the relationship between amorphization and melting has so far not been investigated. Here we show how heating MOFs of zeolitic topology first results in a low density ‘perfect' glass, similar to those formed in ice, silicon and disaccharides. This order–order transition leads to a super-strong liquid of low fragility that dynamically controls collapse, before a subsequent order–disorder transition, which creates a more fragile high-density liquid. After crystallization to a dense phase, which can be remelted, subsequent quenching results in a bulk glass, virtually identical to the high-density phase. We provide evidence that the wide-ranging melting temperatures of zeolitic MOFs are related to their network topologies and opens up the possibility of ‘melt-casting' MOF glasses. PMID:26314784

  5. Hybrid glasses from strong and fragile metal-organic framework liquids.

    PubMed

    Bennett, Thomas D; Tan, Jin-Chong; Yue, Yuanzheng; Baxter, Emma; Ducati, Caterina; Terrill, Nick J; Yeung, Hamish H-M; Zhou, Zhongfu; Chen, Wenlin; Henke, Sebastian; Cheetham, Anthony K; Greaves, G Neville

    2015-01-01

    Hybrid glasses connect the emerging field of metal-organic frameworks (MOFs) with the glass formation, amorphization and melting processes of these chemically versatile systems. Though inorganic zeolites collapse around the glass transition and melt at higher temperatures, the relationship between amorphization and melting has so far not been investigated. Here we show how heating MOFs of zeolitic topology first results in a low density 'perfect' glass, similar to those formed in ice, silicon and disaccharides. This order-order transition leads to a super-strong liquid of low fragility that dynamically controls collapse, before a subsequent order-disorder transition, which creates a more fragile high-density liquid. After crystallization to a dense phase, which can be remelted, subsequent quenching results in a bulk glass, virtually identical to the high-density phase. We provide evidence that the wide-ranging melting temperatures of zeolitic MOFs are related to their network topologies and opens up the possibility of 'melt-casting' MOF glasses. PMID:26314784

  6. Hybrid glasses from strong and fragile metal-organic framework liquids

    NASA Astrophysics Data System (ADS)

    Bennett, Thomas D.; Tan, Jin-Chong; Yue, Yuanzheng; Baxter, Emma; Ducati, Caterina; Terrill, Nick J.; Yeung, Hamish H.-M.; Zhou, Zhongfu; Chen, Wenlin; Henke, Sebastian; Cheetham, Anthony K.; Greaves, G. Neville

    2015-08-01

    Hybrid glasses connect the emerging field of metal-organic frameworks (MOFs) with the glass formation, amorphization and melting processes of these chemically versatile systems. Though inorganic zeolites collapse around the glass transition and melt at higher temperatures, the relationship between amorphization and melting has so far not been investigated. Here we show how heating MOFs of zeolitic topology first results in a low density `perfect' glass, similar to those formed in ice, silicon and disaccharides. This order-order transition leads to a super-strong liquid of low fragility that dynamically controls collapse, before a subsequent order-disorder transition, which creates a more fragile high-density liquid. After crystallization to a dense phase, which can be remelted, subsequent quenching results in a bulk glass, virtually identical to the high-density phase. We provide evidence that the wide-ranging melting temperatures of zeolitic MOFs are related to their network topologies and opens up the possibility of `melt-casting' MOF glasses.

  7. Experimental investigations of the entrapment and persistence of organic liquid contaminants in the subsurface environment.

    PubMed Central

    Abriola, L M; Bradford, S A

    1998-01-01

    Organic liquids are common polluters of the subsurface environment. Once released, these nonaqueous phase liquids (NAPLs) tend to become entrapped within soils and geologic formations where they may serve as long-term contaminant reservoirs. The interphase mass transfer from such entrapped residuals will ultimately control environmental exposure levels as well as the persistence and/or remedial recovery of these contaminants in the subsurface. This paper summarizes National Institute of Environmental Health Sciences-sponsored research designed to investigate and quantify NAPL entrapment and interphase mass transfer in natural porous media. Results of soil column and batch experiments are presented that highlight research findings over the past several years. These experiments explore dissolution and volatilization of hydrocarbons and chlorinated solvents in sandy porous media. Initial concentration levels and long-term recovery rates are shown to depend on fluid flow rate, soil structure, NAPL composition, and soil wetting characteristics. These observations are explained in the context of conceptual models that describe entrapped NAPL morphology and boundary layer transport. The implications of these laboratory findings on the subsurface persistence and recovery of entrapped NAPLs are discussed. Images Figure 1 Figure 3 Figure 9 PMID:9703497

  8. Pulse shape discrimination capability of metal-loaded organic liquid scintillators for a short-baseline reactor neutrino experiment

    NASA Astrophysics Data System (ADS)

    Kim, B. R.; Han, B. Y.; Jeon, E. J.; Joo, K. K.; Kang, Jeongsoo; Khan, N.; Kim, H. J.; Kim, Hyunsoo; Kim, J. Y.; Siyeon, Kim; Kim, S. C.; Kim, Yeongduk; Ko, Y. J.; Lee, Jaison; Lee, Jeong-Yeon; Lee, J. Y.; Ma, K. J.; Park, Hyeonseo; Park, H. K.; Park, K. S.; Seo, K. M.; Seon, Gwang-Min; Yeo, I. S.; Yeo, K. M.

    2015-05-01

    A new short-baseline (SBL) reactor neutrino experiment is proposed to investigate a reactor anti-neutrino anomaly. A liquid scintillator (LS) is used to detect anti-neutrinos emitted from a Hanaro reactor, and the pulse shape discrimination (PSD) ability of the metal-loaded organic LSs is evaluated on small-scale laboratory samples. PSD can be affected by selecting different base solvents, and several of the LSs used two different organic base solvents, such as linear alkyl benzene and di-isopropylnaphthalene. For the metallic content, gadolinium (Gd) or lithium (6Li) was loaded into a home-made organic LS and into a commercially available liquid scintillation cocktail. A feasibility study was performed for the PSD using several different liquid scintillation cocktails. In this work, the preparation and the PSD characteristics of a promising candidate, which will be used in an above-ground environment, are summarized and presented.

  9. Emiflective Display with Integration of Reflective Liquid Crystal Display and Organic Light Emitting Diode

    NASA Astrophysics Data System (ADS)

    Yang, Bo-Ru; Liu, Kang-Hung; Shieh, Han-Ping D.

    2007-01-01

    A novel emi-flective display which integrates a reflective liquid crystal display (R-LCD) and an organic light emitting diode (OLED) was demonstrated, whose OLED achieved a gain factor of 8 in contrast ratio (CR) compared with the conventional OLED. Under the high light ambience, the R-LCD is sustained with the CR of 10:1 at the viewing angle between ± 55°; while in the dim ambience, the OLED is operated with the CR of 5000:1 at ± 50°. By replacing the backlight system with OLED, emi-flective display has the benefits of lighter weight (<90%), thinner form factor (<40%), and lower power consumption (<2%, under sunlight) compared with the conventional LCD; therefore, to be very applicable for mobile products.

  10. Strategies for Detecting Organic Liquids on Soils Using Mid-Infrared Reflection Spectroscopy

    SciTech Connect

    Gallagher, Neal B.; Gassman, Paul L.; Blake, Thomas A.

    2008-06-25

    Stand-off monitoring for chemical spills can provide timely information for clean-up efforts and mid-infrared reflection-absorption spectroscopy is one approach being investigated. Anomaly and target detection strategies were examined for detection of four different low-volatility organic liquids on two different soil types. Several preprocessing and signal weighting strategies were studied. Anomaly detection for C-H bands was very good using second derivative preprocessing and provided similar performance to target detection approaches such as generalized least squares (GLS) and partial least squares (PLS) with detections at soil loads of approximately 0.6 to 1.5 mg/cm2. Good performance was also found for detection of P=O, O–H and C=O bands but the optimal strategy varied. The simplicity and generality of anomaly detection is attractive, however target detection provides more capability for classification.

  11. A novel series of isoreticular metal organic frameworks: realizing metastable structures by liquid phase epitaxy

    NASA Astrophysics Data System (ADS)

    Liu, Jinxuan; Lukose, Binit; Shekhah, Osama; Arslan, Hasan Kemal; Weidler, Peter; Gliemann, Hartmut; Bräse, Stefan; Grosjean, Sylvain; Godt, Adelheid; Feng, Xinliang; Müllen, Klaus; Magdau, Ioan-Bogdan; Heine, Thomas; Wöll, Christof

    2012-12-01

    A novel class of metal organic frameworks (MOFs) has been synthesized from Cu-acetate and dicarboxylic acids using liquid phase epitaxy. The SURMOF-2 isoreticular series exhibits P4 symmetry, for the longest linker a channel-size of 3 × 3 nm2 is obtained, one of the largest values reported for any MOF so far. High quality, ab-initio electronic structure calculations confirm the stability of a regular packing of (Cu++)2- carboxylate paddle-wheel planes with P4 symmetry and reveal, that the SURMOF-2 structures are in fact metastable, with a fairly large activation barrier for the transition to the bulk MOF-2 structures exhibiting a lower, twofold (P2 or C2) symmetry. The theoretical calculations also allow identifying the mechanism for the low-temperature epitaxial growth process and to explain, why a synthesis of this highly interesting, new class of high-symmetry, metastable MOFs is not possible using the conventional solvothermal process.

  12. Single-reactor process for producing liquid-phase organic compounds from biomass

    SciTech Connect

    Dumesic, James A.; Simonetti, Dante A.; Kunkes, Edward L.

    2015-12-08

    Disclosed is a method for preparing liquid fuel and chemical intermediates from biomass-derived oxygenated hydrocarbons. The method includes the steps of reacting in a single reactor an aqueous solution of a biomass-derived, water-soluble oxygenated hydrocarbon reactant, in the presence of a catalyst comprising a metal selected from the group consisting of Cr, Mn, Fe, Co, Ni, Cu, Mo, Tc, Ru, Rh, Pd, Ag, W, Re, Os, Ir, Pt, and Au, at a temperature, and a pressure, and for a time sufficient to yield a self-separating, three-phase product stream comprising a vapor phase, an organic phase containing linear and/or cyclic mono-oxygenated hydrocarbons, and an aqueous phase.

  13. Neutron detection in nuclear astrophysics experiments: study of organic liquid scintillators

    NASA Astrophysics Data System (ADS)

    Ciani, Giovanni Francesco

    2016-02-01

    In order to study the nuclear reaction 13 C(α,n)16 O, crucial for the nucleosynthesis of heavy nuclei (A>58), the LUNA collaboration at Laboratori Nazionali del Gran Sasso, is looking for the best neutron detector to use in the set up. One of the possibilities is to use detectors based on cell filled with Organic Liquid Scintillator BC501A. These detectors are sensible to fast neutron, but also to gamma rays. A Pulse Shape Discrimination process using the Zero Crossing method has been performed to select only signals from neutrons. Comparing the neutron spectra after the Pulse Shape Discrimination and the spectrum from a GEANT4 simulations, the efficiency of the BC501A, in function of the neutron energy and varying the light threshold, has been evaluated.

  14. Organized composites of Carbon Nanotubes and Lyotropic Liquid Crystals at very low Surfactant Concentration

    NASA Astrophysics Data System (ADS)

    Scalia, Giusy; Jo, Hyeran; Park, Ji Hyun; Lagerwall, Jan

    The difficulties in dispersing and organizing carbon nanotubes (CNTs) can be efficiently tackled using surfactant-based lyotropic liquid crystals, combining high nanotube loading with long-range order. A problem with surfactants is, however, that their residues negatively affect CNT device performance. Here we show aligned CNT-lyotropic composites at reduced surfactant concentration. By combining cat- and anionic surfactants a lyotropic nematic phase forms at just 8% surfactant concentration, and CNTs can be well dispersed and aligned in it. The CNTs themselves were first dispersed below the Krafft temperature of the surfactant used for their stabilization, minimizing also its concentration. The composites exhibit very interesting properties with strong sensitivity to the surfactant ratios. They were investigated by Polarized Optical Microscopy and Polarized Raman spectroscopy, and also the electrical properties were studied

  15. Single-reactor process for producing liquid-phase organic compounds from biomass

    DOEpatents

    Dumesic, James A.; Simonetti, Dante A.; Kunkes, Edward L.

    2011-12-13

    Disclosed is a method for preparing liquid fuel and chemical intermediates from biomass-derived oxygenated hydrocarbons. The method includes the steps of reacting in a single reactor an aqueous solution of a biomass-derived, water-soluble oxygenated hydrocarbon reactant, in the presence of a catalyst comprising a metal selected from the group consisting of Cr, Mn, Fe, Co, Ni, Cu, Mo, Tc, Ru, Rh, Pd, Ag, W, Re, Os, Ir, Pt, and Au, at a temperature, and a pressure, and for a time sufficient to yield a self-separating, three-phase product stream comprising a vapor phase, an organic phase containing linear and/or cyclic mono-oxygenated hydrocarbons, and an aqueous phase.

  16. Comparison of neutron spectra measured with three sizes of organic liquid scintillators using differentiation analysis

    NASA Technical Reports Server (NTRS)

    Shook, D. F.; Pierce, C. R.

    1972-01-01

    Proton recoil distributions were obtained by using organic liquid scintillators of different size. The measured distributions are converted to neutron spectra by differentiation analysis for comparison to the unfolded spectra of the largest scintillator. The approximations involved in the differentiation analysis are indicated to have small effects on the precision of neutron spectra measured with the smaller scintillators but introduce significant error for the largest scintillator. In the case of the smallest cylindrical scintillator, nominally 1.2 by 1.3 cm, the efficiency is shown to be insensitive to multiple scattering and to the angular distribution to the incident flux. These characteristics of the smaller scintillator make possible its use to measure scalar flux spectra within media high efficiency is not required.

  17. Dynamics at the Liquid-Vapor Interface of a Supercooled Organic Glass Former

    NASA Astrophysics Data System (ADS)

    Sikorski, M.; Gutt, C.; Chushkin, Y.; Lippmann, M.; Franz, H.

    2010-11-01

    We investigated the dynamics near the liquid-vapor interface of the supercooled model organic glass former dibutyl phthalate by using surface-sensitive x-ray scattering techniques. Our results reveal significant enhancement of the relaxation rate over a wide length-scales range. The analysis of the dispersion relation of long-wavelength surface fluctuations yields a nonzero value of the share modulus near the free surface. At the molecular level, the dynamics in the near surface region (10-15 nm) is inhomogeneous. The mobility is decreasing with increasing distance from the free surface. Below the bulk glass transition, two distinct relaxation times were observed differing by 1 order of magnitude. The observed fast relaxation proves the existence of a high mobility liquidlike surface layer of 10 nm thickness on top of a frozen in bulk system.

  18. CO2 Binding Organic Liquids Gas Capture with Polarity Swing Assisted Regeneration

    SciTech Connect

    Heldebrant, David

    2014-05-31

    This report outlines the comprehensive bench-scale testing of the CO2-binding organic liquids (CO2BOLs) solvent platform and its unique Polarity Swing Assisted Regeneration (PSAR). This study outlines all efforts on a candidate CO2BOL solvent molecule, including solvent synthesis, material characterization, preliminary toxicology studies, and measurement of all physical, thermodynamic and kinetic data, including bench-scale testing. Equilibrium and kinetic models and analysis were made using Aspen Plus™. Preliminary process configurations, a technoeconomic assessment and solvent performance projections for separating CO2 from a subcritical coal-fired power plant are compared to the U.S. Department of Energy's Case 10 monoethanolamine baseline.

  19. Organization of the polarization splay modulated smectic liquid crystal phase by topographic confinement

    PubMed Central

    Ki Yoon, Dong; Deb, Rajdeep; Chen, Dong; Körblova, Eva; Shao, Renfan; Ishikawa, Ken; Rao, Nandiraju V. S.; Walba, David M.; Smalyukh, Ivan I.; Clark, Noel A.

    2010-01-01

    Recently, the topographic patterning of surfaces by lithography and nanoimprinting has emerged as a new and powerful tool for producing single structural domains of liquid crystals and other soft materials. Here the use of surface topography is extended to the organization of liquid crystals of bent-core molecules, soft materials that, on the one hand, exhibit a rich, exciting, and intensely studied array of novel phases, but that, on the other hand, have proved very difficult to align. Among the most notorious in this regard are the polarization splay modulated (B7) phases, in which the symmetry-required preference for ferroelectric polarization to be locally bouquet-like or “splayed” is expressed. Filling space with splay of a single sign requires defects and in the B7 splay is accommodated in the form of periodic splay stripes spaced by defects and coupled to smectic layer undulations. Upon cooling from the isotropic phase this structure grows via a first order transition in the form of an exotic array of twisted filaments and focal conic defects that are influenced very little by classic alignment methods. By contrast, growth under conditions of confinement in rectangular topographic channels is found to produce completely new growth morphology, generating highly ordered periodic layering patterns. The resulting macroscopic order will be of great use in further exploration of the physical properties of bent-core phases and offers a route for application of difficult-to-align soft materials as are encountered in organic electronic and optical applications. PMID:21098307

  20. Organic solar cells based on liquid crystalline and polycrystalline thin films

    NASA Astrophysics Data System (ADS)

    Yoo, Seunghyup

    This dissertation describes the study of organic thin-film solar cells in pursuit of affordable, renewable, and environmentally-friendly energy sources. Particular emphasis is given to the molecular ordering found in liquid crystalline or polycrystalline films as a way to leverage the efficiencies of these types of cells. Maximum efficiencies estimated based on excitonic character of organic solar cells show power conversion efficiencies larger than 10% are possible in principle. However, their performance is often limited due to small exciton diffusion lengths and poor transport properties which may be attributed to the amorphous nature of most organic semiconductors. Discotic liquid crystal (DLC) copper phthalocyanine was investigated as an easily processible building block for solar cells in which ordered molecular arrangements are enabled by a self-organization in its mesophases. An increase in photocurrent and a reduction in series resistance have been observed in a cell which underwent an annealing process. X-ray diffraction (XRD) and atomic force microscopy (AFM) measurements suggest that structural and morphological changes induced after the annealing process are related to these improvements. In an alternative approach, p-type pentacene thin films prepared by physical vapor deposition were incorporated into heterojunction solar cells with C60 as n-type layers. Power conversion efficiencies of 2.7% under broadband illumination (350--900 nm) with a peak external quantum efficiency of 58% have been achieved with the broad spectral coverage across the visible spectrum. Analysis using an exciton diffusion model shows this efficient carrier generation is mainly due to the large exciton diffusion length of pentacene films. Joint XRD and AFM studies reveal that the highly crystalline nature of pentacene films can account for the observed large exciton diffusion length. In addition, the electrical characteristics are studied as a function of light intensity using

  1. Influence of time on metamorphism of sedimentary organic matter in liquid-dominated geothermal systems, western North America.

    USGS Publications Warehouse

    Barker, C.E.

    1983-01-01

    Reflectance data of sedimentary organic matter samples from six liquid-dominated geothermal systems are strongly temperature-dependent. Geologic evidence indicates that reaction duration ranges from approx 103 to 106 yr in these systems that appear to have near-maximum temperatures. The strong temperature dependence of vitrinite reflectance indicates that after about 104 yr, reaction duration has little or no influence on metamorphism of organic matter in liquid-dominated geothermal systems. These data indicate that vitrinite reflectance can be used to determine the maximum temperature reached in hot sedimentary basins of moderate longevity. -after Author

  2. Ionic liquid-based totally organic solvent-free emulsification microextraction coupled with high performance liquid chromatography for the determination of three acaricides in fruit juice.

    PubMed

    Zhang, Jiaheng; Liang, Zhe; Guo, Hao; Gao, Peng; Lu, Runhua; Zhou, Wenfeng; Zhang, Sanbing; Gao, Haixiang

    2013-10-15

    A novel, totally organic solvent-free emulsification microextraction (TEME) technique using ionic liquids (ILs) is proposed in this study. Seven bis(trifluoromethylsulfonyl)imide ionic liquids were synthesized. After comparing the physicochemical properties of the ionic liquids and their application to microextraction experiments, 1-hexyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide ([C6MIM][NTf2]), which has moderate surface tension and viscosity, was selected as the extraction solvent. The dispersion of ILs and mass transfer were accelerated by ultrasound irradiation and temperature control processes. Therefore, no dispersive organic solvent was needed. Several variables, such as ionic liquid volume, duration of the ultrasound extraction, dispersion temperature, ionic strength and centrifugation time were investigated and optimized. Under the optimum conditions, the calibration curve was linear in the range of 0.1-600 μg L(-1) for chlorfenapyr and fenpyroximate and 0.5-600 μg L(-1) for spirodiclofen, with correlation coefficients of 0.9994-0.9999. The enrichment factors were between 261 and 285. The limits of detection (LODs) were 0.02-0.06 μg L(-1). Real fruit juice samples (at fortified levels of 10 μg L(-1) and 30 μg L(-1)) were successfully analyzed using the proposed method. The relative recoveries and enrichment factors were in the range of 92-104%. PMID:24054632

  3. Rapid simultaneous determination of amines and organic acids in citrus using high-performance liquid chromatography.

    PubMed

    Uckoo, Ram M; Jayaprakasha, Guddadarangavvanahally K; Nelson, Shad D; Patil, Bhimanagouda S

    2011-01-15

    Rapid analytical method for the simultaneous separation and determination of amines and organic acids is a vital interest for quality control of citrus and their products. In the present study, a simultaneous high performance liquid chromatography (HPLC) method for the rapid separation of three amines and two organic acids was developed. Chromatographic separation of compounds was achieved using Xbridge C(18) column at ambient temperature, with an isocratic mobile phase of 3mM phosphoric acid at a flow rate of 1.0 mL min(-1). A photodiode array (PDA) detector was used to monitor the eluent at 223 nm and 254 nm with a total analysis time of 10 min. Extraction of amines and organic acids from citrus juice was optimized. The method was validated by tests of linearity, recovery, precision and ruggedness. The limit of detection (LOD) and limit of quantification (LOQ) for amines and ascorbic acid were determined to be 5 ng and 9.8 ng, respectively. All calibration curves showed good linearity (R(2) ≥ 0.9999) within the test ranges. The recoveries of the amines and organic acids ranged between 84% and 117%. The identity of each peak was confirmed by mass spectral (MS) analysis. The developed method was successfully applied to analyze the content of amines and organic acids in six different species and two varieties of citrus. Results indicate that mandarin and Marrs sweet orange contain high level of amines, while pummelo and Rio Red grapefruit had high content of ascorbic acid (137-251 μg mL(-1)) and citric acid (5-22 mg mL(-1)). Synephrine was the major amine present in Clementine (114 μg mL(-1)) and Marrs sweet orange (85 μg mL(-1)). To the best of our knowledge, this is the first report on simultaneous separation and quantification of amines and organic acids in Marrs sweet orange, Meyer lemon, Nova tangerine, Clementine, Ugli tangelo and Wekiwa tangelo. PMID:21147342

  4. Polyphosphate- and glycogen-accumulating organisms in one EBPR system for liquid dairy manure.

    PubMed

    Liu, Ze-Hua; Pruden, Amy; Ogejo, Jactone Arogo; Knowlton, Katharine F

    2014-07-01

    Two enhanced biological phosphorus removal (EBPR) sequencing batch reactors (SBR1, SBR2) treating liquid dairy manure were operated with the same hydraulic retention time (HRT) and solids retention time (SRT), but with different aeration cycles. During eight months of operation, both SBRs achieved good removal of total phosphorus (P) (TP; 56.8 and 73.5% for SBR1 and SBR2 respectively) and of orthophosphate (OP; 76.2 vs. 82.7%, P < 0.05). Growth dynamics of presumptive phosphate-accumulating organisms (PAOs) and glycogen-accumulating organisms (GAOs) were examined by quantitative polymerase chain reaction (qPCR). SBR1 was enriched with a greater abundance of PAOs while SBR2 was characterized by a greater abundance of GAOs. These results demonstrate the capability of EBPR of dairy manure and challenge conventional wisdom, since greater abundance of PAOs in EBPR system was not associated with improved OP removal and greater abundance of GAOs did not indicate deterioration of the EBPR system. PMID:25112034

  5. Enantiomeric Interactions between Liquid Crystals and Organized Monolayers of Tyrosine-Containing Dipeptides

    PubMed Central

    Bai, Yiqun; Abbott, Nicholas L.

    2011-01-01

    We have examined the orientational ordering of nematic liquid crystals (LCs) supported on organized monolayers of dipeptides with the goal of understanding how peptide-based interfaces encode intermolecular interactions that are amplified into supramolecular ordering. By characterizing the orientations of nematic LCs (4-cyano-4′-pentylbiphenyl (5CB) and TL205 (a mixture of mesogens containing cyclohexane-fluorinated biphenyls and fluorinated terphenyls)) on monolayers of either L-cysteine-L-tyrosine, L-cysteine-L-phenylalanine or L-cysteine-L-phosphotyrosine formed on crystallographically textured films of gold, we conclude that patterns of hydrogen bonds generated by the organized monolayers of dipeptides are transduced via macroscopic orientational ordering of the LCs. This conclusion is supported by the observation that the ordering exhibited by the achiral LCs is specific to the enantiomers used to form the dipeptide-based monolayers. The dominate role of the –OH group of tyrosine in dictating the patterns of hydrogen bonds that orient the LCs was also evidenced by the effects of phosphorylation of the tyrosine on the ordering of the LCs. Overall, these results reveal that crystallographic texturing of gold films can direct the formation of monolayers of dipeptides with long-range order, thus unmasking the influence of hydrogen bonding, chirality and phosphorylation on the macroscopic orientational ordering of LCs supported on these surfaces. These results suggest new approaches based on supramolecular assembly for reporting the chemical functionality and stereochemistry of synthetic and biological peptide-based molecules displayed at surfaces. PMID:22091988

  6. Observations and implications of liquid-liquid phase separation at high relative humidities in secondary organic material produced by α-pinene ozonolysis without inorganic salts

    NASA Astrophysics Data System (ADS)

    Renbaum-Wolff, Lindsay; Song, Mijung; Marcolli, Claudia; Zhang, Yue; Liu, Pengfei F.; Grayson, James W.; Geiger, Franz M.; Martin, Scot T.; Bertram, Allan K.

    2016-07-01

    Particles consisting of secondary organic material (SOM) are abundant in the atmosphere. To predict the role of these particles in climate, visibility and atmospheric chemistry, information on particle phase state (i.e., single liquid, two liquids and solid) is needed. This paper focuses on the phase state of SOM particles free of inorganic salts produced by the ozonolysis of α-pinene. Phase transitions were investigated in the laboratory using optical microscopy and theoretically using a thermodynamic model at 290 K and for relative humidities ranging from < 0.5 to 100 %. In the laboratory studies, a single phase was observed from 0 to 95 % relative humidity (RH) while two liquid phases were observed above 95 % RH. For increasing RH, the mechanism of liquid-liquid phase separation (LLPS) was spinodal decomposition. The RH range over which two liquid phases were observed did not depend on the direction of RH change. In the modeling studies, the SOM took up very little water and was a single organic-rich phase at low RH values. At high RH, the SOM underwent LLPS to form an organic-rich phase and a water-rich phase, consistent with the laboratory studies. The presence of LLPS at high RH values can have consequences for the cloud condensation nuclei (CCN) activity of SOM particles. In the simulated Köhler curves for SOM particles, two local maxima were observed. Depending on the composition of the SOM, the first or second maximum can determine the critical supersaturation for activation. Recently researchers have observed inconsistencies between measured CCN properties of SOM particles and hygroscopic growth measured below water saturation (i.e., hygroscopic parameters measured below water saturation were inconsistent with hygroscopic parameters measured above water saturation). The work presented here illustrates that such inconsistencies are expected for systems with LLPS when the water uptake at subsaturated conditions represents the hygroscopicity of an organic

  7. Reactivity of liquid and semisolid secondary organic carbon with chloride and nitrate in atmospheric aerosols

    SciTech Connect

    Wang, Bingbing; O'Brien, Rachel E.; Kelly, Stephen T.; Shilling, John E.; Moffet, Ryan C.; Gilles, Mary K.; Laskin, Alexander

    2015-05-14

    Constituents of secondary organic carbon (SOC) in atmospheric aerosols are often mixed with inorganic components and compose a significant mass fraction of fine particulate matter in the atmosphere. Interactions between SOC and other condensed-phase species are not well understood. Here, we investigate the reactions of liquid-like and semi-solid SOC from ozonolysis of limonene (LSOC) and α-pinene (PSOC) with NaCl using a set of complementary micro-spectroscopic analyses. These reactions result in chloride depletion in the condensed phase, release of gaseous HCl, and formation of organic salts. The reactions attributed to acid displacement by SOC acidic components are driven by the high volatility of HCl. Similar reactions can take place in SOC/NaNO₃ particles. The results show that an increase in SOC mass fraction in the internally mixed SOC/NaCl particles leads to higher chloride depletion. Glass transition temperatures and viscosity of PSOC were estimated for atmospherically relevant conditions. Data show that the reaction extent depends on SOC composition, particle phase state and viscosity, mixing state, temperature, relative humidity (RH), and reaction time. LSOC shows slightly higher potential to deplete chloride than PSOC. Higher particle viscosity at low temperatures and RH can hinder these acid displacement reactions. Formation of organic salts from these overlooked reactions can alter particle physiochemical properties and may affect their reactivity and ability to act as cloud condensation and ice nuclei. The release and potential recycling of HCl and HNO₃ from reacted aerosol particles may have important implications for atmospheric chemistry.

  8. Titanium-scaffolded organic-monolithic stationary phases for ultra-high-pressure liquid chromatography.

    PubMed

    Vonk, Rudy J; Vaast, Axel; Eeltink, Sebastiaan; Schoenmakers, Peter J

    2014-09-12

    Organic-polymer monoliths with overall dimensions larger than one millimetre are prone to rupture - either within the monolith itself or between the monoliths and the containing wall - due to the inevitable shrinkage accompanying the formation of a cross-linked polymeric network. This problem has been addressed by creating titanium-scaffolded poly(styrene-co-divinylbenzene) (S-co-DVB) monoliths. Titanium-scaffolded monoliths were successfully used in liquid chromatography at very high pressures (up to 80MPa) and using gradients spanning the full range of water-acetonitrile compositions (0 to 100%). The kinetic-performance of (50-mm long) titanium-scaffolded monoliths was compared to that of similar monolith created in 1-mm i.d. glass-lined tubing at pressures up to 50MPa. The peak capacities obtained with the titanium-scaffolded column was about 30% lower. An increased Eddy-diffusion, due to the pillar-structure, and a decreased permeability are thought to be the main reasons for this reduced kinetic-performance. No decrease in performance was observed when the titanium-scaffolded columns were operated at pressures of 80MPa for up to 12h. The column-to-column repeatability (n=5) was acceptable in terms of observed peak widths at half heights (RSD ca. 10%) The run-to-run repeatability (n=135) in terms of retention times and peak widths at half height were found to be good. Titanium-scaffolded columns coupled in series up to a combined length of (200mm) were used for the analyses of a complex Escherichia coli protein sample. Our experiments demonstrate that columns based on titanium-scaffolded organic-polymer monolith can be operated under strenuous conditions without loss in performance. The titanium-scaffolded approach makes it feasible to create organic-polymer monoliths in wide-bore columns with accurate temperature control. PMID:25086753

  9. DEMONSTRATION SOLIDIFICATION TESTS CONDUCTED ON RADIOACTIVELY CONTAMINATED ORGANIC LIQUIDS AT THE AECL WHITESHELL LABORATORIES

    SciTech Connect

    Ryz, R. A.; Brunkow, W. G.; Govers, R.; Campbell, D.; Krause, D.

    2002-02-25

    The AECL, Whiteshell Laboratory (WL) near Pinawa Manitoba, Canada, was established in the early 1960's to carry out AECL research and development activities for higher temperature versions of the CANDU{reg_sign} reactor. The initial focus of the research program was the Whiteshell Reactor-1 (WR-1) Organic Cooled Reactor (OCR) that began operation in 1965. The OCR program was discontinued in the early 1970's in favor of the successful heavy-water-cooled CANDU system. WR-1 continued to operate until 1985 in support of AECL nuclear research programs. A consequence of the Federal government's recent program review process was AECL's business decision to discontinue research programs and operations at the Whiteshell Laboratories and to consolidate its' activities at the Chalk River Laboratories. As a result, AECL received government concurrence in 1998 to proceed to plan actions to achieve closure of WL. The planning actions now in progress address the need to safely and effectively transition the WL site from an operational state, in support of AECL's business, to a shutdown and decommissioned state that meets the regulatory requirements for a licensed nuclear site. The decommissioning program that will be required at WL is unique within AECL and Canada since it will need to address the entire research site rather than individual facilities declared redundant. Accordingly, the site nuclear facilities are being systematically placed in a safe shutdown state and planning for the decommissioning work to place the facilities in a secure monitoring and surveillance state is in progress. One aspect of the shutdown activities is to deal with the legacy of radioactively contaminated organic liquid wastes. Use of a polymer powder to solidify these organic wastes was identified as one possibility for improved interim storage of this material pending final disposition.

  10. Reactivity of liquid and semisolid secondary organic carbon with chloride and nitrate in atmospheric aerosols.

    PubMed

    Wang, Bingbing; O'Brien, Rachel E; Kelly, Stephen T; Shilling, John E; Moffet, Ryan C; Gilles, Mary K; Laskin, Alexander

    2015-05-14

    Constituents of secondary organic carbon (SOC) in atmospheric aerosols are often mixed with inorganic components and compose a significant mass fraction of fine particulate matter in the atmosphere. Interactions between SOC and other condensed-phase species are not well understood. Here, we investigate the reactions of liquid-like and semisolid SOC from ozonolysis of limonene (LSOC) and α-pinene (PSOC) with NaCl using a set of complementary microspectroscopic analyses. These reactions result in chloride depletion in the condensed phase, release of gaseous HCl, and formation of organic salts. The reactions attributed to acid displacement by SOC acidic components are driven by the high volatility of HCl. Similar reactions can take place in SOC/NaNO3 particles. The results show that an increase in SOC mass fraction in the internally mixed SOC/NaCl particles leads to higher chloride depletion. Glass transition temperatures and viscosity of PSOC were estimated for atmospherically relevant conditions. Data show that the reaction extent depends on SOC composition, particle phase state and viscosity, mixing state, temperature, relative humidity (RH), and reaction time. LSOC shows slightly higher potential to deplete chloride than PSOC. Higher particle viscosity at low temperatures and RH can hinder these acid displacement reactions. Formation of organic salts from these overlooked reactions can alter particle physiochemical properties and may affect their reactivity and ability to act as cloud condensation and ice nuclei. The release and potential recycling of HCl and HNO3 from reacted aerosol particles may have important implications for atmospheric chemistry. PMID:25386912

  11. Monolithically integrated, flexible display of polymer-dispersed liquid crystal driven by rubber-stamped organic thin-film transistors

    SciTech Connect

    Mach, P.; Rodriguez, S. J.; Nortrup, R.; Wiltzius, P.; Rogers, J. A.

    2001-06-04

    This letter describes the monolithic integration of rubber-stamped thin-film organic transistors with polymer-dispersed liquid crystals (PDLCs) to create a multipixel, flexible display with plastic substrates. We report the electro-optic switching behavior of the PDLCs as driven by the organic transistors, and we show that our displays operate robustly under flexing and have a contrast comparable to that of newsprint. {copyright} 2001 American Institute of Physics.

  12. Dissimilar Crystal Dependence of Vanadium Oxide Cathodes in Organic Carbonate and Safe Ionic Liquid Electrolytes.

    PubMed

    Tartaj, Pedro; Amarilla, Jose M; Morales, Enrique; Vazquez-Santos, Maria B

    2016-01-27

    Advances in Li metal anode stabilization, solid-state electrolytes, and capabilities to insert a variety of active ions (Li(+), Na(+), Mg(2+), and Al(3+)) have renewed the interest in layered vanadium oxides. Here we show that crystal characteristics such as size and crystallinity are fundamental variables that control the dissimilar electrochemical capabilities of 1D vanadium oxides immersed in different electrolytes (organic carbonates and safe electrolytes containing 80% of ionic liquid). We show that this opposite behavior can be understood in terms of a subtle interplay between crystal characteristics (size and crystallinity), electrolyte degradability, and the ionic conductivity of the electrolyte. Thus, through this control we are able to obtain pure 1D vanadium oxides that show reversibility in carbonate electrolytes at a cutoff voltage of 1.5 V (voltage region where insertion of more than two lithium ions is possible). Furthermore, these materials are able to uptake ca. 1.0 mol of Li at a rate of 20C (1C = 295 mAh/g) and retain excellent capabilities (Coulombic efficiency of 98% after 200 cycles at a rate of 5C). Finally, what, to our knowledge, is really remarkable is that this optimization allows building vanadium oxide electrodes with an excellent electrochemical response in a safe electrolyte composition (80% of ionic liquid). Specifically, we reach uptakes also at a cutoff voltage of 1.5 V of ca. 1.0 mol of Li after 200 cycles at 5C (charge/discharge) with Coulombic efficiencies higher than 99.5%. PMID:26743032

  13. Use of volatile organic solvents in headspace liquid-phase microextraction by direct cooling of the organic drop using a simple cooling capsule.

    PubMed

    Ghiasvand, Ali Reza; Yazdankhah, Fatemeh; Hajipour, Somayeh

    2016-08-01

    A low-cost and simple cooling-assisted headspace liquid-phase microextraction device for the extraction and determination of 2,6,6-trimethyl-1,3 cyclohexadiene-1-carboxaldehyde (safranal) in Saffron samples, using volatile organic solvents, was fabricated and evaluated. The main part of the cooling-assisted headspace liquid-phase microextraction system was a cooling capsule, with a Teflon microcup to hold the extracting organic solvent, which is able to directly cool down the extraction phase while the sample matrix is simultaneously heated. Different experimental factors such as type of organic extraction solvent, sample temperature, extraction solvent temperature, and extraction time were optimized. The optimal conditions were obtained as: extraction solvent, methanol (10 μL); extraction temperature, 60°C; extraction solvent temperature, 0°C; and extraction time, 20 min. Good linearity of the calibration curve (R(2) = 0.995) was obtained in the concentration range of 0.01-50.0 μg/mL. The limit of detection was 0.001 μg/mL. The relative standard deviation for 1.0 μg/mL of safranal was 10.7% (n = 6). The proposed cooling-assisted headspace liquid-phase microextraction device was coupled (off-line) to high-performance liquid chromatography and used for the determination of safranal in Saffron samples. Reasonable agreement was observed between the results of the cooling-assisted headspace liquid-phase microextraction high-performance liquid chromatography method and those obtained by a validated ultrasound-assisted solvent extraction procedure. PMID:27311349

  14. CHARACTERIZATION OF ORGANICS IN TANNERY EFFLUENTS BY LIQUID CHROMATOGRAPHY MASS SPECTROMETRY

    EPA Science Inventory

    Combined high performance liquid chromatography mass spectrometry using a moving belt interface has been used to study extracts from five tannery and leather finishing industry discharges. Liquid chromatographic separation was performed with a Zorbax CN column using a normal phas...

  15. Use of Rigid Liquid Crystalline Polypeptides as Alignment Matrices for Organic Nonlinear Optical Molecules.

    NASA Astrophysics Data System (ADS)

    Tokarski, Zbigniew

    The orientation of nonlinear optical (NLO) organic molecules is crucial for the existence of high values for the macroscopic susceptibilities. The orientation and interaction of several smaller NLO active molecules with an easily alignable polypeptide host was investigated to determine which functional groups and molecular shapes would produce the largest orientation with the host material; these parameters included aromatic vs aliphatic, polar vs nonpolar, saturate vs unsaturated hydrocarbons and the length of the guest molecule. The host materials were either poly ( gamma-benzyl-l-glutamate) (PBLG) or poly ( gamma-ethyl-l-glutamate) (PELG) lyotropic liquid crystals. These host polymers formed pseudo-hexagonal crystalline structures with long rigid alpha -helical backbones. The interstitial alignment of the guest molecules was dictated by the overall alignment of the host polypeptide rigid rods. Within these films many of the guest molecules existed in a metastable state that delayed phase separation for several hours. The rate of phase separation was influenced by the concentration of the guest molecule and on the side chain moiety of the polypeptide. Guest phase separation to a solid or a liquid occurred at a faster rate in PELG films, due to the lack of the side chain induced hindrance, than in PBLG films. An indicator of the occurrence of phase separation was with the onset of opaqueness in the films. The thin polypeptide films containing the aligned guest molecules became optically opaque as the incompatibilities between the side chains of the polypeptides and the guest molecules increased. The nonlinear optical susceptibility measurements were hampered by either the low guest solubility or the low concentration level required to avoid the guest -host incompatibility. Electro-optic and degenerate two and four wave mixing were done and produced signals in solutions but not in the doped films. The semiflexible aromatic guest molecules, such as the derivatives

  16. Chemically modified polymeric resins for separation of cations, organic acids, and small polar moleculea by high performance liquid chromatography

    SciTech Connect

    Morris, J.B.

    1993-07-01

    This thesis is divided into 4 parts: a review, ion chromatography of metal cations on carboxylic resins, separation of hydrophilic organic acids and small polar compounds on macroporous resin columns, and use of eluent modifiers for liquid chromatographic separation of carboxylic acids using conductivity detection.

  17. Air-assisted liquid-liquid microextraction by solidifying the floating organic droplets for the rapid determination of seven fungicide residues in juice samples.

    PubMed

    You, Xiangwei; Xing, Zhuokan; Liu, Fengmao; Zhang, Xu

    2015-05-22

    A novel air assisted liquid-liquid microextraction using the solidification of a floating organic droplet method (AALLME-SFO) was developed for the rapid and simple determination of seven fungicide residues in juice samples, using the gas chromatography with electron capture detector (GC-ECD). This method combines the advantages of AALLME and dispersive liquid-liquid microextraction based on the solidification of floating organic droplets (DLLME-SFO) for the first time. In this method, a low-density solvent with a melting point near room temperature was used as the extraction solvent, and the emulsion was rapidly formed by pulling in and pushing out the mixture of aqueous sample solution and extraction solvent for ten times repeatedly using a 10-mL glass syringe. After centrifugation, the extractant droplet could be easily collected from the top of the aqueous samples by solidifying it at a temperature lower than the melting point. Under the optimized conditions, good linearities with the correlation coefficients (γ) higher than 0.9959 were obtained and the limits of detection (LOD) varied between 0.02 and 0.25 μgL(-1). The proposed method was applied to determine the target fungicides in juice samples and acceptable recoveries ranged from 72.6% to 114.0% with the relative standard deviations (RSDs) of 2.3-13.0% were achieved. Compared with the conventional DLLME method, the newly proposed method will neither require a highly toxic chlorinated solvent for extraction nor an organic dispersive solvent in the application process; hence, it is more environmentally friendly. PMID:25937106

  18. Analytical interferences of mercuric chloride preservative in environmental water samples: Determination of organic compounds isolated by continuous liquid-liquid extraction or closed-loop stripping

    USGS Publications Warehouse

    Foreman, W.T.; Zaugg, S.D.; Falres, L.M.; Werner, M.G.; Leiker, T.J.; Rogerson, P.F.

    1992-01-01

    Analytical interferences were observed during the determination of organic compounds in groundwater samples preserved with mercuric chloride. The nature of the interference was different depending on the analytical isolation technique employed. (1) Water samples extracted with dichloromethane by continuous liquid-liquid extraction (CLLE) and analyzed by gas chromatography/mass spectrometry revealed a broad HgCl2 'peak' eluting over a 3-5-min span which interfered with the determination of coeluting organic analytes. Substitution of CLLE for separatory funnel extraction in EPA method 508 also resulted in analytical interferences from the use of HgCl2 preservative. (2) Mercuric chloride was purged, along with organic contaminants, during closed-loop stripping (CLS) of groundwater samples and absorbed onto the activated charcoal trap. Competitive sorption of the HgCl2 by the trap appeared to contribute to the observed poor recoveries for spiked organic contaminants. The HgCl2 was not displaced from the charcoal with the dichloromethane elution solvent and required strong nitric acid to achieve rapid, complete displacement. Similar competitive sorption mechanisms might also occur in other purge and trap methods when this preservative is used.

  19. Dissolution of D2EHPA in liquid-liquid extraction process: implication on metal removal and organic content of the treated water.

    PubMed

    Lee, Po-Ching; Li, Chi-Wang; Chen, Jie-Yuan; Li, Ying-Sheng; Chen, Shiao-Shing

    2011-11-15

    Effects of pH, extractant/diluent ratios, and metal concentrations on the extent of extractant dissolution during liquid-liquid extraction were investigated. Experimental result shows that D(2)EHPA dissolution increases dramatically at pH above 4, leveling off at pH 6-7. The phenomenon is consistent with deprotonation of D(2)EHPA and the domination of negatively charged D(2)EHPA species at pH of higher than 4. Concentration of D(2)EHPA in the aqueous phase, i.e., the extent of extractant dissolution, drops after addition of metal and decreases with increasing metal concentration. The amount of D(2)EHPA 're-entering' the organic phase is calculated to be 2.04 mol per mol of Cd added, which is quite closed to the stoichiometric molar ratio of 2 between D(2)EHPA and Cd via ion exchange reaction. The effect of metal species on the extent of extractant/metal complexes re-entering is in the order of Cd ≈ Zn > Ag, which might be coincident to the complexation stability of these metals with D(2)EHPA. The extent of extractant dissolution in liquid-liquid extraction process depends on the type and concentration of metal to be removed, pH of aqueous phase, and extractant/diluent ratios. PMID:21937070

  20. Application of thermogravimetric analysis to study the thermal degradation of solid and liquid organic wastes

    SciTech Connect

    E.S. Lygina; A.F. Dmitruk; S.B. Lyubchik; V.F. Tret'yakov

    2009-07-01

    In this work, the thermolysis of composite binary mixtures of refinery or coal-processing waste with waste biomass and D-grade (long-flame) coal was analyzed in order to increase the efficiency of the cothermolysis of chemically different organic wastes mainly because of the synergism of the thermolysis of mixture components and, correspondingly, the selectivity of formation of high-quality by-products (solid, gaseous, or liquid). A new approach to the analysis of thermogravimetric data was proposed and developed as applied to complex binary mixtures of carbon-containing materials. This approach was based on (1) the preliminary separation of the thermal degradation of individual carbon-containing mixture components into individual structural constituents and (2) the monitoring of the conversion of each particular structure fragment as a constituent of the mixtures in the course of the cothermolysis of the mixtures of starting components. Based on the approach developed, data on the main synergism effects in the course of cothermolysis in the binary test systems were obtained: the temperature regions of the appearance of these effects were distinguished, the main conclusions were made with respect to particular structure fragments in complex organic wastes responsible for the interaction of components in composite systems, and the directions (positive or negative) of changes in the yields of solid by-products and the degrees of effects (difference between the yields of cothermolysis by-products in each particular region of the appearance of synergistic effects in the systems) were determined. Additionally, the influence of alkali metal carbonate additives on synergistic effects in the interaction between binary system components under the process conditions of cothermolysis was analyzed.

  1. Organized Assemblies of Colloids Formed at the Poles of Micrometer-Sized Droplets of Liquid Crystal

    PubMed Central

    Wang, Xiaoguang; Miller, Daniel S.; de Pablo, Juan J.

    2014-01-01

    We report on the formation of organized assemblies of 1 μm-in-diameter colloids (polystyrene (PS)) at the poles of water-dispersed droplets (diameters 7 - 20 μm) of nematic liquid crystal (LC). For 4-cyano-4′-pentylbiphenyl droplets decorated with two to five PS colloids, we found 32 distinct arrangements of the colloids to form at the boojums of bipolar droplet configurations. Significantly, all but one of these configurations (a ring comprised of five PS colloids) could be mapped onto a local (non-close packed) hexagonal lattice. To provide insight into the origin of the hexagonal lattice, we investigated planar aqueous—LC interfaces, and found that organized assemblies of PS colloids did not form at these interfaces. Experiments involving the addition of salts revealed that a repulsive interaction of electrostatic origin prevented formation of assemblies at planar interfaces, and that regions of high splay near the poles of the LC droplets generated cohesive interactions between colloids that could overcome the repulsion. Support for this interpretation was obtained from a model that included (i) a long-range attraction between adsorbed colloids and the boojum due to the increasing rate of strain (splay) of LC near the boojum (splay attraction), (ii) an attractive inter-colloid interaction that reflects the quadrupolar symmetry of the strain in the LC around the colloids, and (iii) electrostatic repulsion between colloids. The model predicts that electrostatic repulsion between colloids can lead to a ∼1,000 kBT energy barrier at planar interfaces of LC films, and that the repulsive interaction can be overcome by splay attraction of the colloids to the boojums of the LC droplets. Overall, the results reported in this paper advance our understanding of the directed assembly of colloids at interfaces of LC droplets. PMID:25284139

  2. Analysis of volatile aldehyde biomarkers in human blood by derivatization and dispersive liquid-liquid microextraction based on solidification of floating organic droplet method by high performance liquid chromatography.

    PubMed

    Lili, Lv; Xu, Hui; Song, Dandan; Cui, Yanfang; Hu, Sheng; Zhang, Ganbing

    2010-04-16

    A new dispersive liquid-liquid microextraction based on solidification of floating organic droplet method (DLLME-SFO) was developed for the determination of volatile aldehyde biomarkers (hexanal and heptanal) in human blood samples. In the derivatization and extraction procedure, 2,4-dinitrophenylhydrazine (DNPH) as derivatization reagent and formic acid as catalyzer were injected into the sample solution for derivatization with aldehydes, then the formed hydrazones was rapidly extracted by dispersive liquid-liquid microextraction with 1-dodecanol as extraction solvent. After centrifugation, the floated droplet was solidified in an ice bath and was easily removed for analysis. The effects of various experimental parameters on derivatization and extraction conditions were studied, such as the kind and volume of extraction solvent and dispersive solvent, the amount of derivatization reagent, derivatization temperature and time, extraction time and salt effect. The limit of detections (LODs) for hexanal and heptanal were 7.90 and 2.34nmolL(-1), respectively. Good reproducibility and recovery of the method were also obtained. The proposed method is an alternative approach to the quantification of volatile aldehyde biomarkers in complex biological samples, being more rapid and simpler and providing higher sensitivity compared with the traditional dispersive liquid-liquid microextraction (DLLME) methods. PMID:20181347

  3. Measurement of neutron dose with an organic liquid scintillator coupled with a spectrum weight function.

    PubMed

    Kim, E; Endo, A; Yamaguchi, Y; Yoshizawa, M; Nakamura, T

    2002-01-01

    A dose evaluation method for neutrons in the energy range of a few MeV to 100 MeV has been developed using a spectrum weight function (G-function), which is applied to an organic liquid scintillator of 12.7 cm in diameter and 12.7 cm in length. The G-function that converts the pulse height spectrum of the scintillator into the ambient dose equivalent, H*(10), was calculated by an unfolding method using successive approximation of the response function of the scintillator and the ambient dose equivalent per unit neutron fluence (H*(10) conversion coefficients) of ICRP 74. To verify the response function of the scintillator and the value of H*(10) evaluated by the G-function. pulse height spectra of the scintillator were measured in some different neutron fields, which have continuous energy, monoenergetic and quasi-monoenergetic spectra. Values of H*(10) estimated using the G-function and pulse height spectra of the scintillator were compared with those calculated using neutron energy spectra. These doses agreed with each other. From the results, it was concluded that H*(10) can be evaluated directly from the pulse height spectrum of the scintillator by applying the G-function proposed in this study. PMID:12212900

  4. A molecular nematic liquid crystalline material for high-performance organic photovoltaics

    NASA Astrophysics Data System (ADS)

    Sun, Kuan; Xiao, Zeyun; Lu, Shirong; Zajaczkowski, Wojciech; Pisula, Wojciech; Hanssen, Eric; White, Jonathan M.; Williamson, Rachel M.; Subbiah, Jegadesan; Ouyang, Jianyong; Holmes, Andrew B.; Wong, Wallace W. H.; Jones, David J.

    2015-01-01

    Solution-processed organic photovoltaic cells (OPVs) hold great promise to enable roll-to-roll printing of environmentally friendly, mechanically flexible and cost-effective photovoltaic devices. Nevertheless, many high-performing systems show best power conversion efficiencies (PCEs) with a thin active layer (thickness is ~100 nm) that is difficult to translate to roll-to-roll processing with high reproducibility. Here we report a new molecular donor, benzodithiophene terthiophene rhodanine (BTR), which exhibits good processability, nematic liquid crystalline behaviour and excellent optoelectronic properties. A maximum PCE of 9.3% is achieved under AM 1.5G solar irradiation, with fill factor reaching 77%, rarely achieved in solution-processed OPVs. Particularly promising is the fact that BTR-based devices with active layer thicknesses up to 400 nm can still afford high fill factor of ~70% and high PCE of ~8%. Together, the results suggest, with better device architectures for longer device lifetime, BTR is an ideal candidate for mass production of OPVs.

  5. A molecular nematic liquid crystalline material for high-performance organic photovoltaics.

    PubMed

    Sun, Kuan; Xiao, Zeyun; Lu, Shirong; Zajaczkowski, Wojciech; Pisula, Wojciech; Hanssen, Eric; White, Jonathan M; Williamson, Rachel M; Subbiah, Jegadesan; Ouyang, Jianyong; Holmes, Andrew B; Wong, Wallace W H; Jones, David J

    2015-01-01

    Solution-processed organic photovoltaic cells (OPVs) hold great promise to enable roll-to-roll printing of environmentally friendly, mechanically flexible and cost-effective photovoltaic devices. Nevertheless, many high-performing systems show best power conversion efficiencies (PCEs) with a thin active layer (thickness is ~100 nm) that is difficult to translate to roll-to-roll processing with high reproducibility. Here we report a new molecular donor, benzodithiophene terthiophene rhodanine (BTR), which exhibits good processability, nematic liquid crystalline behaviour and excellent optoelectronic properties. A maximum PCE of 9.3% is achieved under AM 1.5G solar irradiation, with fill factor reaching 77%, rarely achieved in solution-processed OPVs. Particularly promising is the fact that BTR-based devices with active layer thicknesses up to 400 nm can still afford high fill factor of ~70% and high PCE of ~8%. Together, the results suggest, with better device architectures for longer device lifetime, BTR is an ideal candidate for mass production of OPVs. PMID:25586307

  6. Posaconazole liquid suspension in solid organ transplant recipients previously treated with voriconazole

    PubMed Central

    Shoham, S.; Ostrander, D.; Marr, K.

    2015-01-01

    Background Posaconazole (PCZ) has become an attractive alternative to voriconazole (VCZ) in transplant recipients with suspected or proven invasive filamentous fungal infections, given fewer drug interactions. Here, we describe our experience with PCZ after VCZ in solid organ transplant (SOT) recipients. Methods VCZ was replaced by PCZ liquid solution in 19 SOT recipients (15 lung, 2 kidney, 1 liver, and 1 heart/lung) with invasive pulmonary aspergillosis (12/19; 63.2%), possible invasive pulmonary fungal infection (2/19; 10.5%), prophylaxis (2/19; 10.5%), or pulmonary scedosporiosis, mucormycosis, and mixed fungal species (1 each). Rationales for switch were suspected adverse reactions to VCZ (17/19; 89.4 %) and desire to broaden spectrum of coverage to include agents of mucormycosis (3/19; 15.8 %). Results PCZ was well tolerated in all patients. In those patients with baseline liver enzyme abnormalities, a median change occurred in concentrations of alanine transaminase (–20 IU/L), aspartate aminotransferase (–17.5 IU/L), and alkaline phosphatase (–61.5 IU/L). Clinical success (resolution, stabilization, or prevention of infection) was achieved in 16/19 (84%) people. Conclusion PCZ appears to have a reasonable safety and tolerability profile and may be an effective alternative in SOT patients who require an agent with anti-mold activity, but are unable to tolerate VCZ. PMID:25846433

  7. A molecular nematic liquid crystalline material for high-performance organic photovoltaics

    PubMed Central

    Sun, Kuan; Xiao, Zeyun; Lu, Shirong; Zajaczkowski, Wojciech; Pisula, Wojciech; Hanssen, Eric; White, Jonathan M.; Williamson, Rachel M.; Subbiah, Jegadesan; Ouyang, Jianyong; Holmes, Andrew B.; Wong, Wallace W.H.; Jones, David J.

    2015-01-01

    Solution-processed organic photovoltaic cells (OPVs) hold great promise to enable roll-to-roll printing of environmentally friendly, mechanically flexible and cost-effective photovoltaic devices. Nevertheless, many high-performing systems show best power conversion efficiencies (PCEs) with a thin active layer (thickness is ~100 nm) that is difficult to translate to roll-to-roll processing with high reproducibility. Here we report a new molecular donor, benzodithiophene terthiophene rhodanine (BTR), which exhibits good processability, nematic liquid crystalline behaviour and excellent optoelectronic properties. A maximum PCE of 9.3% is achieved under AM 1.5G solar irradiation, with fill factor reaching 77%, rarely achieved in solution-processed OPVs. Particularly promising is the fact that BTR-based devices with active layer thicknesses up to 400 nm can still afford high fill factor of ~70% and high PCE of ~8%. Together, the results suggest, with better device architectures for longer device lifetime, BTR is an ideal candidate for mass production of OPVs. PMID:25586307

  8. A simple theory of molecular organization in fullerene-containing liquid crystals

    NASA Astrophysics Data System (ADS)

    Peroukidis, S. D.; Vanakaras, A. G.; Photinos, D. J.

    2005-10-01

    Systematic efforts to synthesize fullerene-containing liquid crystals have produced a variety of successful model compounds. We present a simple molecular theory, based on the interconverting shape approach [Vanakaras and Photinos, J. Mater. Chem. 15, 2002 (2005)], that relates the self-organization observed in these systems to their molecular structure. The interactions are modeled by dividing each molecule into a number of submolecular blocks to which specific interactions are assigned. Three types of blocks are introduced, corresponding to fullerene units, mesogenic units, and nonmesogenic linkage units. The blocks are constrained to move on a cubic three-dimensional lattice and molecular flexibility is allowed by retaining a number of representative conformations within the block representation of the molecule. Calculations are presented for a variety of molecular architectures including twin mesogenic branch monoadducts of C60, twin dendromesogenic branch monoadducts, and conical (badminton shuttlecock) multiadducts of C60. The dependence of the phase diagrams on the interaction parameters is explored. In spite of its many simplifications and the minimal molecular modeling used (three types of chemically distinct submolecular blocks with only repulsive interactions), the theory accounts remarkably well for the phase behavior of these systems.

  9. Formation of a new archetypal Metal-Organic Framework from a simple monatomic liquid

    NASA Astrophysics Data System (ADS)

    Metere, Alfredo; Oleynikov, Peter; Dzugutov, Mikhail; O'Keeffe, Michael

    2014-12-01

    We report a molecular-dynamics simulation of a single-component system of particles interacting via a spherically symmetric potential that is found to form, upon cooling from a liquid state, a low-density porous crystalline phase. Its structure analysis demonstrates that the crystal can be described by a net with a topology that belongs to the class of topologies characteristic of the Metal-Organic Frameworks (MOFs). The observed net is new, and it is now included in the Reticular Chemistry Structure Resource database. The observation that a net topology characteristic of MOF crystals, which are known to be formed by a coordination-driven self-assembly process, can be reproduced by a thermodynamically stable configuration of a simple single-component system of particles opens a possibility of using these models in studies of MOF nets. It also indicates that structures with MOF topology, as well as other low-density porous crystalline structures can possibly be produced in colloidal systems of spherical particles, with an appropriate tuning of interparticle interaction.

  10. Formation of a new archetypal Metal-Organic Framework from a simple monatomic liquid

    SciTech Connect

    Metere, Alfredo Oleynikov, Peter; Dzugutov, Mikhail; O’Keeffe, Michael

    2014-12-21

    We report a molecular-dynamics simulation of a single-component system of particles interacting via a spherically symmetric potential that is found to form, upon cooling from a liquid state, a low-density porous crystalline phase. Its structure analysis demonstrates that the crystal can be described by a net with a topology that belongs to the class of topologies characteristic of the Metal-Organic Frameworks (MOFs). The observed net is new, and it is now included in the Reticular Chemistry Structure Resource database. The observation that a net topology characteristic of MOF crystals, which are known to be formed by a coordination-driven self-assembly process, can be reproduced by a thermodynamically stable configuration of a simple single-component system of particles opens a possibility of using these models in studies of MOF nets. It also indicates that structures with MOF topology, as well as other low-density porous crystalline structures can possibly be produced in colloidal systems of spherical particles, with an appropriate tuning of interparticle interaction.

  11. Ionic liquid-based zwitterionic organic polymer monolithic column for capillary hydrophilic interaction chromatography.

    PubMed

    Wang, Tingting; Chen, Yihui; Ma, Junfeng; Zhang, Xiaodan; Zhang, Lihua; Zhang, Yukui

    2015-08-21

    In the current study, a novel ionic liquid-based zwitterionic organic polymer monolithic column was developed by copolymerizing 1-vinyl-3-(butyl-4-sulfonate) imidazolium, acrylamide and N,N'-methylenebisacrylamide in a quaternary porogenic solvent consisting of formamide, dimethyl sulphoxide, polyethylene glycol 8000 and polyethylene glycol 10,000 for capillary hydrophilic interaction chromatography. The monolithic stationary phase was optimized by adjusting the amount of monomer in the polymerization solution along with the composition of porogenic solvent. The optimized monolith exhibited excellent selectivity and favorable retention for nucleosides and benzoic acid derivatives. The primary factors affecting the separation efficiency of the monolithic column (including acetonitrile content, pH, and buffer salt concentration in the mobile phase) have been thoroughly evaluated. Excellent reproducibility of the retention times for five nucleosides was achieved, with relative standard deviations of run-to-run (n = 3), column-to-column (n = 3) and batch-to-batch (n = 3) in the range of 0.18-0.48%, 2.33-4.20% and 3.07-6.50%, respectively. PMID:26114194

  12. A novel series of isoreticular metal organic frameworks: realizing metastable structures by liquid phase epitaxy

    PubMed Central

    Liu, Jinxuan; Lukose, Binit; Shekhah, Osama; Arslan, Hasan Kemal; Weidler, Peter; Gliemann, Hartmut; Bräse, Stefan; Grosjean, Sylvain; Godt, Adelheid; Feng, Xinliang; Müllen, Klaus; Magdau, Ioan-Bogdan; Heine, Thomas; Wöll, Christof

    2012-01-01

    A novel class of metal organic frameworks (MOFs) has been synthesized from Cu-acetate and dicarboxylic acids using liquid phase epitaxy. The SURMOF-2 isoreticular series exhibits P4 symmetry, for the longest linker a channel-size of 3 × 3 nm2 is obtained, one of the largest values reported for any MOF so far. High quality, ab-initio electronic structure calculations confirm the stability of a regular packing of (Cu++)2- carboxylate paddle-wheel planes with P4 symmetry and reveal, that the SURMOF-2 structures are in fact metastable, with a fairly large activation barrier for the transition to the bulk MOF-2 structures exhibiting a lower, twofold (P2 or C2) symmetry. The theoretical calculations also allow identifying the mechanism for the low-temperature epitaxial growth process and to explain, why a synthesis of this highly interesting, new class of high-symmetry, metastable MOFs is not possible using the conventional solvothermal process. PMID:23213357

  13. Dispersive liquid-liquid microextraction based on the solidification of floating organic drop followed by ICP-MS for the simultaneous determination of heavy metals in wastewaters

    NASA Astrophysics Data System (ADS)

    Li, Yong; Peng, Guilong; He, Qiang; Zhu, Hui; Al-Hamadani, Sulala M. Z. F.

    2015-04-01

    In the present work, a dispersive liquid-liquid microextraction based on the solidification of floating organic drop (DLLME-SFO) combined with inductively coupled plasma mass spectrometry (ICP-MS) was developed for the determination of Pb, Co, Cu, Ni, Zn. The influences of analytical parameters, including pH, extraction solvent volume, disperser solvent volume, concentration of chelating agent on the quantitative recoveries of Pb, Co, Cu, Ni, Zn were investigated. The effect of the interfering ions on the analytes recovery was also investigated. Under the optimized conditions, the limits of detection were 0.97-2.18 ng L-1. The relative standard deviations (RSDs) were 2.62-4.51% (n = 7, C = 20 ng L-1). The proposed method was successfully applied for the analysis of ultra trace metals in wastewater samples.

  14. Structural organization, micro-phase separation and polyamorphism of liquid MgSiO3 under compression

    NASA Astrophysics Data System (ADS)

    San, Luyen Thi; Van Hong, Nguyen; Iitaka, Toshiaki; Hung, Pham Khac

    2016-03-01

    The structure, structural change and micro-phase separation in liquid MgSiO3 under pressure are studied by molecular dynamics simulation with pair-wise potentials. Models consisting of 5000 atoms are constructed at 3500 K in the 0-30 GPa pressure range. The structural organization and structural phase transition under compression as well as network topology of liquid MgSiO3 are clarified through analysis and visualization of molecular dynamics simulation data. The short-range structure, intermediate-range structure and the degree of polymerization as well as structural, compositional and dynamical heterogeneities are also discussed in detail.

  15. Estimation of the Heat Capacities of Organic Liquids as a Function of Temperature using Group Additivity. I. Hydrocarbon Compounds

    NASA Astrophysics Data System (ADS)

    Růžička, Vlastimil; Domalski, Eugene S.

    1993-05-01

    A second-order group additivity method has been developed for the estimation of the heat capacity of liquid hydrocarbons as a function of temperature in the range from the melting temperature to the normal boiling temperature. The temperature dependence of group contributions and structural corrections has been represented by a polynomial expression. The adjustable parameters in the polynomials have been calculated using a weighted least squares minimization procedure. Recommended heat capacities from a large compilation of critically evaluated data that contains over 1300 organic liquids served as a database both for the development and testing of the method.

  16. Organic vapor sensing with ionic liquids entrapped in alumina nanopores on quartz crystal resonators.

    PubMed

    Goubaidoulline, Ilchat; Vidrich, Gabriele; Johannsmann, Diethelm

    2005-01-15

    We report on a concept for vapor sensing with the quartz crystal microbalance where the vapor phase is absorbed into small droplets of an ionic liquid. The liquid is contained in the pores of a nanoporous alumina layer, created on the front electrode of the quartz crystal by anodization. Ionic liquids are attractive for vapor sensing because--being liquids--they equilibrate very fast, while at the same time having negligible vapor pressure. Containing the ionic liquids inside cylindrical cavities of a solid matrix removes all problems related to the liquid's softness as well as the possibility of dewetting and flow. The absence of viscoelastic effects is evidenced by the fact that the bandwidth of the resonance remains unchanged during the uptake of solvent vapor. The Henry constants for a number of solvents have been measured. PMID:15649061

  17. Fertilization with liquid digestate in organic farming - effects on humus balance, soil potassium contents and soil physical properties

    NASA Astrophysics Data System (ADS)

    Erhart, Eva; Siegl, Thomas; Bonell, Marion; Unterfrauner, Hans; Peticzka, Robert; Ableidinger, Christoph; Haas, Dieter; Hartl, Wilfried

    2014-05-01

    Biogas production and use of liquid digestate are subject of controversial discussion in organic farming. Using biomass from intercrops as feedstock for biogas production makes it possible to produce renewable energy without compromising food production. With liquid digestate, crops can be fertilized in a more targeted way than by incorporating intercrop biomass into the soil. For long-term sustainability in organic farming, however, this practice must not have adverse effects on soil fertility. In order to assess the effects of fertilization with liquid digestate on soil fertility, two randomised field experiments were conducted for two years on different soil types near Bruck/Leitha (Lower Austria). One experiment was set up on a calcareous chernozem with 4 % humus content, the other on a parachernozem with pH 5.9 and 2.1 % humus. Soil potassium content, both in the water-soluble fraction and in the exchangeable fraction, increased significantly at both sites. As fertilization with liquid digestate exceeded the potassium requirements of the crops by far, the proportion of potassium of the exchangeable cations increased rapidly. Soil physical properties were not influenced by digestate fertilization on the chernozem site. On the parachernozem, aggregate stability was increased by the organic matter applied via digestate. On this acidic site low in humus content, the supply of 4 t/ha organic matter, which featured a lignin content of 37 % and was relatively resistant to decomposition, had a clearly positive impact on soil physical properties. Humus balances were computed both with the 'Humuseinheiten'-method and with the site-adapted method STAND. They were calculated on the basis of equal amounts of intercrop biomass either left on the field as green manure or used for biogas production and the resulting amount of liquid digestate brought back to the field. The humus balances indicated that the humus-efficacy of the liquid digestate was equal to slightly higher

  18. Investigation of a Particle into Liquid Sampler to Study the Formation & Ageing of Secondary Organic Aerosol

    NASA Astrophysics Data System (ADS)

    Pereira, K. L.; Hamilton, J. F.; Rickard, A. R.; Bloss, W. J.; Alam, M. S.; Camredon, M.; Munoz, A.; Vazquez, M.; Rodenas, M.; Vera, T.; Borrás, E.

    2012-12-01

    The atmospheric oxidation of Volatile Organic Compounds (VOCs) in the presence of NOx results in the formation of tropospheric ozone and Secondary Organic Aerosol (SOA) [Hallquist et al., 2009]. Whilst SOA is known to affect both climate and human health, the VOC oxidation pathways leading to SOA formation are poorly understood [Solomon et al., 2007]. This is in part due to the vast number and the low concentration of SOA species present in the ambient atmosphere. It has been estimated as many as 10,000 to 100,000 VOCs have been detected in the atmosphere, all of which can undergo photo-chemical oxidation and contribute to SOA formation [Goldstein and Galbally, 2007]. Atmospheric simulation chambers such as the EUropean PHOtoREactor (EUPHORE) in Valencia, Spain, are often used to study SOA formation from a single VOC precursor under controlled conditions. SOA composition and formation can be studied using online techniques such as Aerosol Mass Spectrometry (AMS), which provide high time resolution but limited structural information [Zhang et al., 2007]. Offline techniques, such as collection onto filters, extraction and subsequent analysis, provide detailed SOA composition but only usually one or two samples per experiment. In this work we report time resolved SOA composition analysis using a Particle into Liquid Sampler (PILS) followed by Liquid Chromatography Ion-Trap Mass Spectrometry (LC-IT-MS/MS) and Fourier Transform Ion Cyclotron Resonance Mass Spectrometry (FTICR-MS/MS). Experiments were performed at EUPHORE investigating the formation and composition of Methyl Chavicol SOA. Methyl Chavicol (also known as Estragole) was identified as the highest floral emission from an oil palm plantation in Malaysian Borneo and has also been observed in US pine forests [Bouvier-Brown et al., 2009; Misztal et al., 2010]. Previous studies indicate a high SOA yield from Methyl Chavicol at around 40 % [Lee et al., 2006], however currently there have been very few literature

  19. Preconcentration of valsartan by dispersive liquid-liquid microextraction based on solidification of floating organic drop and its determination in urine sample: Central composite design.

    PubMed

    Pebdani, Arezou Amiri; Shabani, Ali Mohammad Haji; Dadfarnia, Shayesteh; Talebianpoor, Mohammad Sharif; Khodadoust, Saeid

    2016-05-01

    In this work, a fast, easy, and efficient dispersive liquid-liquid microextraction method based on solidification of floating organic drop followed by high-performance liquid chromatography with UV detection was developed for the separation/preconcentration and determination of the drug valsartan. Experimental design was applied for the optimization of the effective variables (such as volume of extracting and dispersing solvents, ionic strength, and pH) on the extraction efficiency of valsartan from urine samples. The optimized values were 250.0 μL ethanol, 65.0 μL 1-dodecanol, 4.0% w/v NaCl, pH 3.8, 1.0 min extraction time, and 4.0 min centrifugation at 4000 rpm min(-1) . The linear response (r(2) = 0.997) was obtained in the range of 0.013-10.0 μg mL(-1) with a limit of detection of 4.0 ng mL(-1) and relative standard deviations of less than 5.0 % (n = 6). PMID:26991865

  20. Touch sensors based on planar liquid crystal-gated-organic field-effect transistors

    SciTech Connect

    Seo, Jooyeok; Lee, Chulyeon; Han, Hyemi; Lee, Sooyong; Nam, Sungho; Kim, Youngkyoo; Kim, Hwajeong; Lee, Joon-Hyung; Park, Soo-Young; Kang, Inn-Kyu

    2014-09-15

    We report a tactile touch sensor based on a planar liquid crystal-gated-organic field-effect transistor (LC-g-OFET) structure. The LC-g-OFET touch sensors were fabricated by forming the 10 μm thick LC layer (4-cyano-4{sup ′}-pentylbiphenyl - 5CB) on top of the 50 nm thick channel layer (poly(3-hexylthiophene) - P3HT) that is coated on the in-plane aligned drain/source/gate electrodes (indium-tin oxide - ITO). As an external physical stimulation to examine the tactile touch performance, a weak nitrogen flow (83.3 μl/s) was employed to stimulate the LC layer of the touch device. The LC-g-OFET device exhibited p-type transistor characteristics with a hole mobility of 1.5 cm{sup 2}/Vs, but no sensing current by the nitrogen flow touch was measured at sufficiently high drain (V{sub D}) and gate (V{sub G}) voltages. However, a clear sensing current signal was detected at lower voltages, which was quite sensitive to the combination of V{sub D} and V{sub G}. The best voltage combination was V{sub D} = −0.2 V and V{sub G} = −1 V for the highest ratio of signal currents to base currents (i.e., signal-to-noise ratio). The change in the LC alignment upon the nitrogen flow touch was assigned as the mechanism for the present LC-g-OFET touch sensors.

  1. Graphene-based supercapacitors in the parallel-plate electrode configuration: ionic liquids versus organic electrolytes.

    PubMed

    Shim, Youngseon; Kim, Hyung J; Jung, Younjoon

    2012-01-01

    Supercapacitors with two single-sheet graphene electrodes in the parallel plate geometry are studied via molecular dynamics (MD) computer simulations. Pure 1-ethyl-3-methylimidazolium tetrafluoroborate (EMI+BF4-) and a 1.1 M solution of EMI+BF4- in acetonitrile are considered as prototypes of room-temperature ionic liquids (RTILs) and organic electrolytes. Electrolyte structure, charge density and associated electric potential are investigated by varying the charges and separation of the two electrodes. Multiple charge layers formed in the electrolytes in the vicinity of the electrodes are found to screen the electrode surface charge almost completely. As a result, the supercapacitors show nearly an ideal electric double layer behavior, i.e., the electric potential exhibits essentially a plateau behavior in the entire electrolyte region except for sharp changes in screening zones very close to the electrodes. Due to its small size and large charge separation, BF4- is considerably more efficient in shielding electrode charges than EMI+. In the case of the acetonitrile solution, acetonitrile also plays an important role by aligning its dipoles near the electrodes; however, the overall screening mainly arises from ions. Because of the disparity of shielding efficiency between cations and anions, the capacitance of the positively-charged anode is significantly larger than that of the negatively-charged cathode. Therefore, the total cell capacitance in the parallel plate configuration is primarily governed by the cathode. Ion conductivity obtained via the Green-Kubo (GK) method is found to be largely independent of the electrode surface charge. Interestingly, EMI+BF4- shows higher GK ion conductivity than the 1.1 M acetonitrile solution between two parallel plate electrodes. PMID:22455024

  2. Organics Analyzer for Sampling Icy Surfaces: A liquid chromatograph-mass spectrometer for future in situ small body missions

    NASA Astrophysics Data System (ADS)

    Getty, Stephanie A.; Dworkin, Jason P.; Glavin, Daniel P.; Martin, Mildred; Zheng, Yun; Balvin, Manuel; Southard, Adrian E.; Feng, Steven; Ferrance, Jerome; Kotecki, Carl; Malespin, Charles; Mahaffy, Paul R.

    Liquid chromatography mass spectrometry (LC-MS) is an important laboratory technique for the detection and analysis of organic molecules with high sensitivity and selectivity. This approach has been especially fruitful in the analysis of nucleobases, amino acids, and measuring amino acid enantiomeric ratios in extraterrestrial materials. We are developing OASIS, Organics Analyzer for Sampling Icy Surfaces, for in situ analysis on future landed missions to astrochemically important icy bodies, such as asteroids, comets, and icy moons. The OASIS design employs a microfabricated, on-chip analytical column to chromatographically separate liquid analytes using known LC stationary phase chemistries. The elution products are then interfaced through spray ionization and analyzed by a time-of-flight mass spectrometer (TOF-MS). A particular advantage of our design is its suitability for microgravity environments, such as for a primitive small body.

  3. Anomalously slow relaxation of the system of strongly interacting liquid clusters in a disordered nanoporous medium: Self-organized criticality

    NASA Astrophysics Data System (ADS)

    Borman, V. D.; Tronin, V. N.

    2016-09-01

    It has been shown that changes in the energy of a system of nonwetting liquid clusters confined in a random nanoporous medium in the process of relaxation can be written in the quasiparticle approximation in the form of the sum of the energies of local (metastable) configurations of liquid clusters interacting with clusters in the connected nearest pores. The energy spectrum and density of states of the local configuration have been calculated. It has been shown that the relaxation of the state of the system occurs through the scenario of self-organized criticality (SOC). The process is characterized by the expectation of a fluctuation necessary for overcoming a local energy barrier of the metastable state with the subsequent rapid hydrodynamic extrusion of the liquid under the action of the surface buoyancy forces of the nonwetting framework. In this case, the dependence of the interaction between local configurations on the number of filled pores belonging to the infinite percolation cluster of filled pores serves as an internal feedback initiating the SOC process. The calculations give a power-law time dependence of the relative volume of the confined liquid θ ∼t-α(α ∼ 0.1) . The developed model of the relaxation of the porous medium with the nonwetting liquid demonstrates possible mechanisms and scenarios of SOC for disordered atomic systems.

  4. Evaluation of the water and organic liquids extraction efficiency of Spirulina maxima dyes using thermostated micro thin-layer chromatography.

    PubMed

    Zarzycki, Paweł K; Zarzycka, Magdalena B

    2008-01-01

    Thermostated micro thin-layer chromatography was applied for separation and quantification studies of Spirulina maxima dyes isolated from pharmaceutical formulation by a simple one-step liquid extraction. The isolation process was performed using a number of liquids, including water; 10 mM water solutions of native alpha-, beta-, and gamma-cyclodextrin and their hydroxypropyl derivatives; and a number of common organic liquids characterized by different polarity, namely, methanol, ethanol, 1-propanol, 2-propanol, acetonitrile, acetone, tetrahydrofuran, dichloromethane, toluene, and n-hexane. Chromatographic studies were performed on RP18W plates working inside a small thermostated horizontal chamber allowing a development distance of 45 mm. Using a mobile phase consisting of acetone-n-hexane (30 + 70, v/v) and 40 degrees C separation temperature, plate peak capacity of at least 15 spots/lane and developing time <5 min were obtained. Validation data indicated that under such conditions, with an office scanner used for chromatogram digitalization, spot quantification could be accurately performed within an analyte mass range of 2 factors. The raw quantitative data obtained from microchromatograms acquired under visible light conditions were explored using cluster analysis and principal components analysis. Chemometric investigations revealed that the best extraction liquids for isolation of dye mixtures from Spirulina samples were methanol, ethanol, tetrahydrofuran, and dichloromethane. Moreover, it was found that the liquids' parachor values could be used for estimation of the dye extraction efficiency from complex samples. PMID:18980141

  5. Analysis of the organic liquid produced from catalytic cracking of crude palm oil in the presence of alumina supported catalysts

    NASA Astrophysics Data System (ADS)

    Ramli, Anita; Razak, Rozlina Abdul

    2012-09-01

    Catalytic cracking of crude palm oil (CPO) was studied in the presence of alumina, 1% Pt/Al2O3 and 1% Pd/Al2O3 as catalyst. The CPO to catalyst weight ratio used was 1:0.05. The experiment was carried out in a simple liquid-phase batch reactor at atmospheric pressure where the sample was heated to 300-350 δC. Products formed were organic liquid products (OLP) and gaseous product with the solid residue remains in the reactor. The total conversion of CPO was only between 25 - 31% where the residue is suggested to be mainly of polimerised CPO. The OLP was analysed using a gas chromatography with FID detector. Analyses show that the selectivity to liquid fuel is influence by the catalyst used whereby Al2O3 gives the highest selectivity to gasoline while 1% Pt/Al2O3 has the highest selectivity to diesel. However, 1% Pd/Al2O3 is not a suitable catalyst for catalytic cracking of CPO to liquid fuel where less than 17.5% of OLP produced could be classified as liquid fuel.

  6. Microextraction techniques coupled to liquid chromatography with mass spectrometry for the determination of organic micropollutants in environmental water samples.

    PubMed

    Padrón, Ma Esther Torres; Afonso-Olivares, Cristina; Sosa-Ferrera, Zoraida; Santana-Rodríguez, José Juan

    2014-01-01

    Until recently, sample preparation was carried out using traditional techniques, such as liquid-liquid extraction (LLE), that use large volumes of organic solvents. Solid-phase extraction (SPE) uses much less solvent than LLE, although the volume can still be significant. These preparation methods are expensive, time-consuming and environmentally unfriendly. Recently, a great effort has been made to develop new analytical methodologies able to perform direct analyses using miniaturised equipment, thereby achieving high enrichment factors, minimising solvent consumption and reducing waste. These microextraction techniques improve the performance during sample preparation, particularly in complex water environmental samples, such as wastewaters, surface and ground waters, tap waters, sea and river waters. Liquid chromatography coupled to tandem mass spectrometry (LC/MS/MS) and time-of-flight mass spectrometric (TOF/MS) techniques can be used when analysing a broad range of organic micropollutants. Before separating and detecting these compounds in environmental samples, the target analytes must be extracted and pre-concentrated to make them detectable. In this work, we review the most recent applications of microextraction preparation techniques in different water environmental matrices to determine organic micropollutants: solid-phase microextraction SPME, in-tube solid-phase microextraction (IT-SPME), stir bar sorptive extraction (SBSE) and liquid-phase microextraction (LPME). Several groups of compounds are considered organic micropollutants because these are being released continuously into the environment. Many of these compounds are considered emerging contaminants. These analytes are generally compounds that are not covered by the existing regulations and are now detected more frequently in different environmental compartments. Pharmaceuticals, surfactants, personal care products and other chemicals are considered micropollutants. These compounds must be

  7. Observing the Growth of Metal-Organic Frameworks by In-Situ Liquid Cell Transmission Electron Microscopy

    SciTech Connect

    Patterson, Joseph P.; Abellan Baeza, Patricia; Denny, Michael S.; Park, Chiwoo; Browning, Nigel D.; Cohen, Seth M.; Evans, James E.; Gianneschi, Nathan C.

    2015-06-17

    Liquid Cell Transmission Electron Microscopy (LCTEM) can provide direct observations of solution phase nanoscale materials, and holds great promise as a tool for monitoring dynamic self assembly processes. Control over particle behavior within the liquid cell, and under electron beam irradiation, is of paramount importance for this technique to contribute to our understanding of chemistry and materials science at the nanoscale. However, this type of control has not been demonstrated for complex, organic macromolecular materials, which form the basis for all biological systems, all of polymer science, and encompass important classes of advanced porous materials. Here we show that by controlling the liquid cell surface chemistry and electron beam effects, the dynamics and self-assembly of metal-organic frameworks (MOFs) can be observed. Our results demonstrate that hybrid organic/inorganic beam sensitive materials can be analyzed with LCTEM and at least in the case of Zif-8 dynamics, the results correlate with observations from bulk growth or other standard synthetic conditions. We anticipate that direct, nanoscale imaging by LCTEM of MOF nucleation and growth mechanisms, may provide insight into controlled MOF crystal morphology, domain composition, and processes influencing defect formation.

  8. Liquid-drop technique for generation of organic glass and metal shells

    SciTech Connect

    Hendricks, C.D.

    1981-12-23

    We have for several years utilized the technique of capillary wave synchronization of the break-up of single and multiple component jets to produce uniform sized liquid drops and solid particles, and hollow liquid and solid shells. The technique has also been used to encapsulate a number of liquids in impermeable spherical shells. Highly uniform glass shells have been made by generating uniform drops of glass forming materials in an aqueous solution, subsequently evaporating the water, and then fusing and blowing the remaining solids in a high temperature vertical tube furnace. Experimental results will be presented and the critical problems in further research in this field will be discussed.

  9. Chiral all-organic nitroxide biradical liquid crystals showing remarkably large positive magneto-LC effects.

    PubMed

    Suzuki, Katsuaki; Takemoto, Yusa; Takaoka, Shohei; Taguchi, Koji; Uchida, Yoshiaki; Mazhukin, Dmitrii G; Grigor'ev, Igor A; Tamura, Rui

    2016-03-11

    The liquid crystalline chiral nitroxide biradical (S,S,S,S)-3 synthesized has shown much larger 'positive magneto-LC effects' in the chiral nematic (N*) phase than the monoradical (S,S)-1. PMID:26871609

  10. Partition coefficients of organic compounds between water and imidazolium-, pyridinium-, and phosphonium-based ionic liquids.

    PubMed

    Padró, Juan M; Pellegrino Vidal, Rocío B; Reta, Mario

    2014-12-01

    The partition coefficients, P IL/w, of several compounds, some of them of biological and pharmacological interest, between water and room-temperature ionic liquids based on the imidazolium, pyridinium, and phosphonium cations, namely 1-octyl-3-methylimidazolium hexafluorophosphate, N-octylpyridinium tetrafluorophosphate, trihexyl(tetradecyl)phosphonium chloride, trihexyl(tetradecyl)phosphonium bromide, trihexyl(tetradecyl)phosphonium bis(trifluoromethylsulfonyl)imide, and trihexyl(tetradecyl)phosphonium dicyanamide, were accurately measured. In this way, we extended our database of partition coefficients in room-temperature ionic liquids previously reported. We employed the solvation parameter model with different probe molecules (the training set) to elucidate the chemical interactions involved in the partition process and discussed the most relevant differences among the three types of ionic liquids. The multiparametric equations obtained with the aforementioned model were used to predict the partition coefficients for compounds (the test set) not present in the training set, most being of biological and pharmacological interest. An excellent agreement between calculated and experimental log P IL/w values was obtained. Thus, the obtained equations can be used to predict, a priori, the extraction efficiency for any compound using these ionic liquids as extraction solvents in liquid-liquid extractions. PMID:25326892