Sample records for ionic liquid pil

  1. Synthesis of ionic liquids

    DOE Patents [OSTI]

    Dai, Sheng [Knoxville, TN; Luo, Huimin [Knoxville, TN

    2008-09-09T23:59:59.000Z

    Ionic compounds which are liquids at room temperature are formed by the method of mixing a neutral organic liqand with the salt of a metal cation and its conjugate anion. The liquids are hydrophobic, conductive and stable and have uses as solvents and in electrochemical devices.

  2. Synthesis of ionic liquids

    DOE Patents [OSTI]

    Dai, Sheng (Knoxville, TN); Luo, Huimin (Knoxville, TN)

    2011-11-01T23:59:59.000Z

    Ionic compounds which are liquids at room temperature are formed by the method of mixing a neutral organic ligand with the salt of a metal cation and its conjugate anion. The liquids are hydrophobic, conductive and stable and have uses as solvents and in electrochemical devices.

  3. Ionic liquids for rechargeable lithium batteries

    E-Print Network [OSTI]

    Salminen, Justin; Papaiconomou, Nicolas; Kerr, John; Prausnitz, John; Newman, John

    2008-01-01T23:59:59.000Z

    M. Armand, “Room temperature molten salts as lithium batteryZ. Suarez, “Ionic liquid (molten salt) phase organometallic

  4. Ionic Liquids for Utilization of Geothermal Energy

    Broader source: Energy.gov [DOE]

    DOE Geothermal Program Peer Review 2010 - Presentation. Project objective: to develop ionic liquids for two geothermal energy related applications.

  5. Nanoparticle enhanced ionic liquid heat transfer fluids

    DOE Patents [OSTI]

    Fox, Elise B.; Visser, Ann E.; Bridges, Nicholas J.; Gray, Joshua R.; Garcia-Diaz, Brenda L.

    2014-08-12T23:59:59.000Z

    A heat transfer fluid created from nanoparticles that are dispersed into an ionic liquid is provided. Small volumes of nanoparticles are created from e.g., metals or metal oxides and/or alloys of such materials are dispersed into ionic liquids to create a heat transfer fluid. The nanoparticles can be dispersed directly into the ionic liquid during nanoparticle formation or the nanoparticles can be formed and then, in a subsequent step, dispersed into the ionic liquid using e.g., agitation.

  6. Ionic Liquid Pretreatment Technologies

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative Fuels Data Center Home Page on Google Bookmark EERE: Alternative Fuels Data Center Home Page onYouTube YouTube Note: Since the.pdfBreaking ofOil & Gas » Methane HydrateEnergy InvestmentsWorld DesignIonic

  7. Early Events in Ionic Liquid Radiation Chemistry

    SciTech Connect (OSTI)

    Wishart, J.F.; Cook, A.; Rimmer, R.D.; Gohdo, M.

    2010-09-14T23:59:59.000Z

    Ionic liquids are interesting and useful materials whose solvation time scales are up to thousands of times longer than in conventional solvents. The extended lifetimes of pre-solvated electrons and other energetic species in ionic liquids has profound consequences for the radiolytic product distributions and reactivity patterns. We use a newly developed, multiplexed variation of pulse-probe spectroscopy to measure the kinetics of the early dynamical and reactive events in ionic liquids.

  8. Ionic liquids for rechargeable lithium batteries

    E-Print Network [OSTI]

    Salminen, Justin; Papaiconomou, Nicolas; Kerr, John; Prausnitz, John; Newman, John

    2008-01-01T23:59:59.000Z

    molten salts as lithium battery electrolyte,” ElectrochimicaFigure 15. Rechargeable lithium-ion battery. Figure 16 showsbattery. It is essential that an ionic liquid – lithium salt

  9. Interfacial ionic liquids: connecting static and dynamic...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    structures separated by an energy barrier (0.15 eV). Keywords: ionic liquid, supercapacitor, electric double layer, epitaxial graphene, x-ray reflectivity, RTIL, interfacial...

  10. Supported Ionic Liquid Membranes for Gas Separation

    SciTech Connect (OSTI)

    Myers, C.R.; Ilconich, J.B.; Pennline, H.W.; Luebke, D.R.

    2007-08-01T23:59:59.000Z

    Ionic liquids have been rapidly gaining attention for various applications including solvent separation and gas capture. These substances are noted for extremely low vapor pressure and high CO2 solubility making them ideal as transport or capture media for CO2 abatement in power generation applications. Ionic liquids, combined with various supports to form membranes, have been proven selective in CO2 separation. Several ionic liquids and a variety of polymer supports have been studied over a temperature range from 37°C to 300°C and have been optimized for stability. The membranes have demonstrated high permeability and high selectivity since the supported ionic liquid membranes incorporate functionality capable of chemically complexing CO2. A study aimed at improving supported ionic liquid membranes will examine their durability with greater transmembrane pressures and the effects on CO2 permeance, CO2/H2 selectivity and thermal stability.

  11. Elucidating graphene - Ionic Liquid interfacial region: a combined...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    graphene - Ionic Liquid interfacial region: a combined experimental and computational study. Elucidating graphene - Ionic Liquid interfacial region: a combined experimental and...

  12. New lithium-based ionic liquid electrolytes that resist salt...

    Energy Savers [EERE]

    lithium-based ionic liquid electrolytes that resist salt concentration polarization New lithium-based ionic liquid electrolytes that resist salt concentration polarization...

  13. Ionic Liquids as Multifunctional Ashless Additives for Engine...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Multifunctional Ashless Additives for Engine Lubrication Ionic Liquids as Multifunctional Ashless Additives for Engine Lubrication A group of oil-miscible ionic liquids has been...

  14. Phosphonium-based ionic liquids and uses

    DOE Patents [OSTI]

    Del Sesto, Rico E; Koppisch, Andrew T; Lovejoy, Katherine S; Purdy, Geraldine M

    2014-12-30T23:59:59.000Z

    Phosphonium-based room temperature ionic liquids ("RTILs") were prepared. They were used as matrices for Matrix-Assisted Laser Desorption Ionization (MALDI) mass spectrometry and also for preparing samples of dyes for analysis.

  15. Superbase-derived protic ionic liquids

    DOE Patents [OSTI]

    Dai, Sheng; Luo, Huimin; Baker, Gary A.

    2013-09-03T23:59:59.000Z

    Protic ionic liquids having a composition of formula (A.sup.-)(BH.sup.+) wherein A.sup.- is a conjugate base of an acid HA, and BH.sup.+ is a conjugate acid of a superbase B. In particular embodiments, BH.sup.+ is selected from phosphazenium species and guanidinium species encompassed, respectively, by the general formulas: ##STR00001## The invention is also directed to films and membranes containing these protic ionic liquids, with particular application as proton exchange membranes for fuel cells.

  16. TETRAALKYLPHOSPHONIUM POLYOXOMETALATES AS NOVEL IONIC LIQUIDS.

    SciTech Connect (OSTI)

    DIETZ,M.L.; RICKERT, P.G.; ANTONIO, M.R.; FIRESTONE, M.A.; WISHART, J.F.; SZREDER, T.

    2007-11-30T23:59:59.000Z

    The pairing of a Lindqvist or Keggin polyoxometalate (POM) anion with an appropriate tetraalkylphosphonium cation, [R{sub 3}R{prime}P]{sup +}, has been shown to yield an original family of ionic liquids (POM-ILs), among them salts liquid at or near ambient temperature. The physicochemical properties of several such 'inorganic liquids', in particular their thermal properties, suggests the possible application of these compounds as robust, thermally-stable solvents for liquid-liquid extraction. A preliminary evaluation of the potential of POM-ILs in this application is presented.

  17. Acetonitrile Drastically Boosts Conductivity of Ionic Liquids

    E-Print Network [OSTI]

    Chaban, Vitaly V; Kalugin, Oleg N; Prezhdo, Oleg V

    2012-01-01T23:59:59.000Z

    We apply a new methodology in the force field generation (PCCP 2011, 13, 7910) to study the binary mixtures of five imidazolium-based room-temperature ionic liquids (RTILs) with acetonitrile (ACN). The investigated RTILs are composed of tetrafluoroborate (BF4) anion and dialkylimidazolium cations, where one of the alkyl groups is methyl for all RTILs, and the other group is different for each RTILs, being ethyl (EMIM), butyl (BMIM), hexyl (HMIM), octyl (OMIM), and decyl (DMIM). Specific densities, radial distribution functions, ionic cluster distributions, heats of vaporization, diffusion constants, shear viscosities, ionic conductivities, and their correlations are discussed. Upon addition of ACN, the ionic conductivity of RTILs is found to increase by more than 50 times, that significantly exceeds an impact of most known solvents. Remarkably, the sharpest conductivity growth is found for the long-tailed imidazolium-based cations. This new fact motivates to revisit an application of these binary systems as a...

  18. Metal-air low temperature ionic liquid cell

    DOE Patents [OSTI]

    Friesen, Cody A; Buttry, Daniel A

    2014-11-25T23:59:59.000Z

    The present application relates to an electrochemical metal-air cell in which a low temperature ionic liquid is used.

  19. VOC and HAP recovery using ionic liquids

    SciTech Connect (OSTI)

    Michael R. Milota : Kaichang Li

    2007-05-29T23:59:59.000Z

    During the manufacture of wood composites, paper, and to a lesser extent, lumber, large amounts of volatile organic compounds (VOCs) such as terpenes, formaldehyde, and methanol are emitted to air. Some of these compounds are hazardous air pollutants (HAPs). The air pollutants produced in the forest products industry are difficult to manage because the concentrations are very low. Presently, regenerative thermal oxidizers (RTOs and RCOs) are commonly used for the destruction of VOCs and HAPs. RTOs consume large amounts of natural gas to heat air and moisture. The combustion of natural gas generates increased CO2 and NOx, which have negative implications for global warming and air quality. The aforementioned problems are addressed by an absorption system containing a room-temperature ionic liquid (RTIL) as an absorbent. RTILs are salts, but are in liquid states at room temperature. RTILs, an emerging technology, are receiving much attention as replacements for organic solvents in industrial processes with significant cost and environmental benefits. Some of these processes include organic synthesis, extraction, and metal deposition. RTILs would be excellent absorbents for exhausts from wood products facilities because of their unique properties: no measurable vapor pressure, high solubility of wide range of organic compounds, thermal stability to 200°C (almost 400°F), and immisciblity with water. Room temperature ionic liquids were tested as possible absorbents. Four were imidizolium-based and were eight phosphonium-based. The imidizolium-based ionic liquids proved to be unstable at the conditions tested and in the presence of water. The phosphonium-based ionic liquids were stable. Most were good absorbents; however, cleaning the contaminates from the ionic liquids was problematic. This was overcome with a higher temperature (120°C) than originally proposed and a very low pressure (1 kPa. Absorption trials were conducted with tetradecy(trihexyl)phosphonium dicyanamide as the RTIL. It was determined that it has good absorption properties for methanol and ?-pinene, is thermally stable, and is relatively easy to synthesize. It has a density of 0.89 g/mL at 20°C and a molecular weight of 549.9 g/mol. Trials were conducted with a small absorption system and a larger absorption system. Methanol, formaldehyde, and other HAPs were absorbed well, nearly 100%. Acetaldehyde was difficult to capture. Total VOC capture, while satisfactory on methanol and ?-pinene in a lab system, was less than expected in the field, 60-80%. The inability to capture the broad spectrum of total organics is likely due to difficulties in cleaning them from the ionic liquid rather than the ability of the ionic liquid to absorb. It’s likely that a commercial system could be constructed to remove 90 to 100% of the gas contaminates. Selecting the correct ionic liquid would be key to this. Absorption may not be the main selection criterion, but rather how easily the ionic liquid can be cleaned is very important. The ionic liquid absorption system might work very well in a system with a limited spectrum of pollutants, such as a paint spray line, where there are not very high molecular weight, non volatile, compounds in the exhaust.

  20. Tribological Properties of Ionic Liquids Lubricants Containing Nanoparticles

    E-Print Network [OSTI]

    Lu, Wei

    2014-05-14T23:59:59.000Z

    and with organic solvents and electrochemical properties [7]. Because of these properties ionic liquids become a new green solvent or lubricant in industrial application. 1.2.2 The application of ionic liquid in tribology 1.2.2.1 Ionic liquids as lubrication...

  1. 1,2,3-triazolium ionic liquids

    DOE Patents [OSTI]

    Luebke, David; Nulwala, Hunaid; Tang, Chau

    2014-12-09T23:59:59.000Z

    The present invention relates to compositions of matter that are ionic liquids, the compositions comprising substituted 1,2,3-triazolium cations combined with any anion. Compositions of the invention should be useful in the separation of gases and, perhaps, as catalysts for many reactions.

  2. Ionic Liquid-Enhanced Solid State Electrolyte Interface (SEI...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Liquid-Enhanced Solid State Electrolyte Interface (SEI) for Lithium Sulfur Batteries. Ionic Liquid-Enhanced Solid State Electrolyte Interface (SEI) for Lithium Sulfur Batteries....

  3. Ionic Liquid Membranes for Carbon Dioxide Separation

    SciTech Connect (OSTI)

    Myers, C.R.; Ilconich, J.B.; Luebke, D.R.; Pennline, H.W.

    2008-07-12T23:59:59.000Z

    Recent scientific studies are rapidly advancing novel technological improvements and engineering developments that demonstrate the ability to minimize, eliminate, or facilitate the removal of various contaminants and green house gas emissions in power generation. The Integrated Gasification Combined Cycle (IGCC) shows promise for carbon dioxide mitigation not only because of its higher efficiency as compared to conventional coal firing plants, but also due to a higher driving force in the form of high partial pressure. One of the novel technological concepts currently being developed and investigated is membranes for carbon dioxide (CO2) separation, due to simplicity and ease of scaling. A challenge in using membranes for CO2 capture in IGCC is the possibility of failure at elevated temperatures or pressures. Our earlier research studies examined the use of ionic liquids on various supports for CO2 separation over the temperature range, 37°C-300°C. The ionic liquid, 1-hexyl-3methylimidazolium Bis(trifluoromethylsulfonyl)imide, ([hmim][Tf2N]), was chosen for our initial studies with the following supports: polysulfone (PSF), poly(ether sulfone) (PES), and cross-linked nylon. The PSF and PES supports had similar performance at room temperature, but increasing temperature caused the supported membranes to fail. The ionic liquid with the PES support greatly affected the glass transition temperature, while with the PSF, the glass transition temperature was only slightly depressed. The cross-linked nylon support maintained performance without degradation over the temperature range 37-300°C with respect to its permeability and selectivity. However, while the cross-linked nylon support was able to withstand temperatures, the permeability continued to increase and the selectivity decreased with increasing temperature. Our studies indicated that further testing should examine the use of other ionic liquids, including those that form chemical complexes with CO2 based on amine interactions. The hypothesis is that the performance at the elevated temperatures could be improved by allowing a facilitated transport mechanism to become dominant. Several amine-based ionic liquids were tested on the cross-linked nylon support. It was found that using the amine-based ionic liquid did improve selectivity and permeability at higher temperature. The hypothesis was confirmed, and it was determined that the type of amine used also played a role in facilitated transport. Given the appropriate aminated ionic liquid with the cross-linked nylon support, it is possible to have a membrane capable of separating CO2 at IGCC conditions. With this being the case, the research has expanded to include separation of other constituents besides CO2 (CO, H2S, etc.) and if they play a role in membrane poisoning or degradation. This communication will discuss the operation of the recently fabricated ionic liquid membranes and the impact of gaseous components other than CO2 on their performance and stability.

  4. Use of ionic liquids as coordination ligands for organometallic catalysts

    DOE Patents [OSTI]

    Li, Zaiwei (Moreno Valley, CA); Tang, Yongchun (Walnut, CA); Cheng; Jihong (Arcadia, CA)

    2009-11-10T23:59:59.000Z

    Aspects of the present invention relate to compositions and methods for the use of ionic liquids with dissolved metal compounds as catalysts for a variety of chemical reactions. Ionic liquids are salts that generally are liquids at room temperature, and are capable of dissolving a many types of compounds that are relatively insoluble in aqueous or organic solvent systems. Specifically, ionic liquids may dissolve metal compounds to produce homogeneous and heterogeneous organometallic catalysts. One industrially-important chemical reaction that may be catalyzed by metal-containing ionic liquid catalysts is the conversion of methane to methanol.

  5. Soft ionization of thermally evaporated hypergolic ionic liquid aerosols

    E-Print Network [OSTI]

    Koh, Christine J.

    2013-01-01T23:59:59.000Z

    + ][Dca ? ]. Figure 2. Aerosol particle size distribution ofhypergolic ionic liquid aerosols Christine J. Koh † , Chen-ionization of evaporated IL aerosols Isolated ion pairs of a

  6. Lipid extraction from microalgae using a single ionic liquid

    DOE Patents [OSTI]

    Salvo, Roberto Di; Reich, Alton; Dykes, Jr., H. Waite H.; Teixeira, Rodrigo

    2013-05-28T23:59:59.000Z

    A one-step process for the lysis of microalgae cell walls and separation of the cellular lipids for use in biofuel production by utilizing a hydrophilic ionic liquid, 1-butyl-3-methylimidazolium. The hydrophilic ionic liquid both lyses the microalgae cell walls and forms two immiscible layers, one of which consists of the lipid contents of the lysed cells. After mixture of the hydrophilic ionic liquid with a suspension of microalgae cells, gravity causes a hydrophobic lipid phase to move to a top phase where it is removed from the mixture and purified. The hydrophilic ionic liquid is recycled to lyse new microalgae suspensions.

  7. Compositions and methods useful for ionic liquid treatment of biomass

    DOE Patents [OSTI]

    Dibble, Dean C.; Cheng, Aurelia; George, Anthe

    2014-07-29T23:59:59.000Z

    The present invention provides for novel compositions and methods for recycling or recovering ionic liquid used in IL pretreated cellulose and/or lignocellulosic biomass (LBM).

  8. Ionic Liquids as Novel Engine Lubricants or Lubricant Additives...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    test results showed that compared with fully-formulated engine oils, selected low-viscosity ionic liquids, used as neat lubricants or basestock, produced significantly lower...

  9. Aprotic Heterocyclic Anion Triazolide Ionic Liquids - A New Class of Ionic Liquid Anion Accessed by the Huisgen Cycloaddition Reaction

    SciTech Connect (OSTI)

    Thompson, Robert L.; Damodaran, Krishnan; Luebke, David; Nulwala, Hunaid

    2013-06-01T23:59:59.000Z

    The triazole core is a highly versatile heterocyclic ring which can be accessed easily with the Cu(I)-catalyzed Huisgen cycloaddition reaction. Herein we present the preparation of ionic liquids that incorporate a 1,2,3-triazolide anion. These ionic liquids were prepared by a facile procedure utilizing a base-labile pivaloylmethyl group at the 1-position, which can act as precursors to 1H- 4-substituted 1,2,3-triazole. These triazoles were then subsequently converted into ionic liquids after deprotonation using an appropriate ionic liquid cation hydroxide. The densities and thermal decompositions of these ionic liquids were measured. These novel ionic liquids have potential applications in gas separations and in metal-free catalysis.

  10. Durable electrooptic devices comprising ionic liquids

    SciTech Connect (OSTI)

    Agrawal, Anoop (Tucson, AZ); Cronin, John P. (Tucson, AZ); Tonazzi, Juan C. L. (Tucson, AZ); Warner, Benjamin P. (Los Alamos, NM); McCleskey, T. Mark (Los Alamos, NM); Burrell, Anthony K. (Los Alamos, NM)

    2005-11-01T23:59:59.000Z

    Electrolyte solutions for electrochromic devices such as rear view mirrors and displays with low leakage currents are prepared using inexpensive, low conductivity conductors. Preferred electrolytes include bifunctional redox dyes and molten salt solvents with enhanced stability toward ultraviolet radiation. The solvents include lithium or quaternary ammonium cations, and perfluorinated sulfonylimide anions selected from trifluoromethylsulfonate (CF3SO3-), bis(trifluoromethylsulfonyl)imide ((CF3SO2)2N-), bis(perfluoroethylsulfonyl)imide ((CF3CF2SO2)2N-) and tris(trifluoromethylsulfonyl)methide ((CF3SO2)3C-). Electroluminescent, electrochromic and photoelectrochromic devices with nanostructured electrodes include ionic liquids with bifunctional redox dyes.

  11. Ionic liquid ion source emitter arrays fabricated on bulk porous substrates for spacecraft propulsion

    E-Print Network [OSTI]

    Courtney, Daniel George

    2011-01-01T23:59:59.000Z

    Ionic Liquid Ion Sources (ILIS) are a subset of electrospray capable of producing bipolar beams of pure ions from ionic liquids. Ionic liquids are room temperature molten salts, characterized by negligible vapor pressures, ...

  12. Studies of ionic liquids in lithium-ion battery test systems

    E-Print Network [OSTI]

    Salminen, Justin; Prausnitz, John M.; Newman, John

    2006-01-01T23:59:59.000Z

    of ionic liquids in lithium-ion battery test systems J.battery point of view, it is essential that an ionic liquid – lithiumlead to battery short-out. The ionic-liquid / lithium-salt

  13. Structure and magnetic behavior of transition metal based ionic liquids

    SciTech Connect (OSTI)

    Del Sesto, Rico E [Los Alamos National Laboratory (LANL); Mccleskey, T [Los Alamos National Laboratory (LANL); Burrell, Anthony K [ORNL; Baker, Gary A [ORNL; Thompson, Joe D. [Los Alamos National Laboratory (LANL); Scott, Brian L. [Los Alamos National Laboratory (LANL); Wilkes, John S [United States Air Force Academy (USAFA), Colorado; Williams, Peg [United States Air Force Academy (USAFA), Colorado

    2008-01-01T23:59:59.000Z

    A series of ionic liquids containing different paramagnetic anions have been prepared and all show paramagnetic behavior with potential applications for magnetic and electrochromic switching as well as novel magnetic transport; also, the tetraalkylphosphonium-based ionic liquids reveal anomalous magnetic behavior.

  14. Graphene terahertz modulators by ionic liquid gating

    E-Print Network [OSTI]

    Wu, Yang; Qiu, Xuepeng; Liu, Jingbo; Deorani, Praveen; Banerjee, Karan; Son, Jaesung; Chen, Yuanfu; Chia, Elbert E M; Yang, Hyunsoo

    2015-01-01T23:59:59.000Z

    Graphene based THz modulators are promising due to the conical band structure and high carrier mobility of graphene. Here, we tune the Fermi level of graphene via electrical gating with the help of ionic liquid to control the THz transmittance. It is found that, in the THz range, both the absorbance and reflectance of the device increase proportionately to the available density of states due to intraband transitions. Compact, stable, and repeatable THz transmittance modulation up to 93% (or 99%) for a single (or stacked) device has been demonstrated in a broad frequency range from 0.1 to 2.5 THz, with an applied voltage of only 3 V at room temperature.

  15. Halogenation of Imidazolium Ionic Liquids. Thermodynamics Perspective

    E-Print Network [OSTI]

    Chaban, Vitaly V

    2015-01-01T23:59:59.000Z

    Imidazolium cations are promising for anion exchange membranes, and electrochemical applications and gas capture. They can be chemically modified in many ways including halogenation. Halogenation possibilities of the imidazole ring constitute a particular interest. This work investigates fluorination and chlorination reactions of all symmetrically non-equivalent sites of the imidazolium cation. Halogenation of all carbon atoms is thermodynamically permitted. Out of these, the most favorable site is the first methylene group of the alkyl chain. In turn, the least favorable site is carbon of the imidazole ring. Temperature dependence of enthalpy, entropy, and Gibbs free energy at 1 bar is discussed. The reported results provide an important guidance in functionalization of ionic liquids in search of task-specific compounds.

  16. Durable electrooptic devices comprising ionic liquids

    SciTech Connect (OSTI)

    Burrell, Anthony K. (Los Alamos, NM); Agrawal, Anoop (Tucson, AZ); Cronin; John P. (Tucson, AZ); Tonazzi, Juan C. L. (Tucson, AZ); Warner, Benjamin P. (Los Alamos, NM); McCleskey, T. Mark (Los Alamos, NM)

    2009-12-15T23:59:59.000Z

    Electrolyte solutions for electrochromic devices such as rear view mirrors and displays with low leakage currents are prepared using inexpensive, low conductivity conductors. Preferred electrolytes include bifunctional redox dyes and molten salt solvents with enhanced stability toward ultraviolet radiation. The solvents include lithium or quaternary ammonium cations, and perfluorinated sulfonylimide anions selected from trifluoromethylsulfonate (CF.sub.3SO.sub.3.sup.-), bis(trifluoromethylsulfonyl)imide ((CF.sub.3SO.sub.2).sub.2N.sup.-), bis(perfluoroethylsulfonyl)imide ((CF.sub.3CF.sub.2SO.sub.2).sub.2N.sup.-) and tris(trifluoromethylsulfonyl)methide ((CF.sub.3SO.sub.2).sub.3C.sup.-). Electroluminescent, electrochromic and photoelectrochromic devices with nanostructured electrodes include ionic liquids with bifunctional redox dyes. Some of the electrolyte solutions color to red when devices employing the solutions are powered, leading to red or neutral electrooptic devices.

  17. Durable Electrooptic Devices Comprising Ionic Liquids

    DOE Patents [OSTI]

    Burrell, Anthony K. (Los Alamos, NM); Agrawal, Anoop (Tucson, AZ); Cronin, John P. (Tucson, AZ); Tonazzi, Juan C. L. (Tucson, AZ); Warner, Benjamin P. (Los Alamos, NM); McCleskey, T. Mark (Los Alamos, NM)

    2008-11-11T23:59:59.000Z

    Electrolyte solutions for electrochromic devices such as rear view mirrors and displays with low leakage currents are prepared using inexpensive, low conductivity conductors. Preferred electrolytes include bifunctional redox dyes and molten salt solvents with enhanced stability toward ultraviolet radiation. The solvents include lithium or quaternary ammonium cations, and perfluorinated sulfonylimide anions selected from trifluoromethylsulfonate (CF.sub.3SO.sub.3.sup.-), bis(trifluoromethylsulfonyl)imide ((CF.sub.3SO.sub.2).sub.2N.sup.-), bis(perfluoroethylsulfonyl)imide ((CF.sub.3CF.sub.2SO.sub.2).sub.2N.sup.-) and tris(trifluoromethylsulfonyl)methide ((CF.sub.3SO.sub.2).sub.3C.sup.-). Electroluminescent, electrochromic and photoelectrochromic devices with nanostructured electrodes include ionic liquids with bifunctional redox dyes. Some of the electrolyte solutions color to red when devices employing the solutions are powered, leading to red or neutral electrooptic devices.

  18. Durable electrooptic devices comprising ionic liquids

    SciTech Connect (OSTI)

    Warner, Benjamin P. (Los Alamos, NM); McCleskey, T. Mark (Los Alamos, NM); Burrell, Anthony K. (Los Alamos, NM)

    2006-10-10T23:59:59.000Z

    Electrolyte solutions for electrochromic devices such as rear view mirrors and displays with low leakage currents are prepared using inexpensive, low conductivity conductors. Preferred electrolytes include bifunctional redox dyes and molten salt solvents with enhanced stability toward ultraviolet radiation. The solvents include lithium or quaternary ammonium cations, and perfluorinated sulfonylimide anions selected from trifluoromethylsulfonate (CF.sub.3SO.sub.3.sup.-), bis(trifluoromethylsulfonyl)imide ((CF.sub.3SO.sub.2).sub.2N.sup.-), bis(perfluoroethylsulfonyl)imide ((CF.sub.3CF.sub.2SO.sub.2).sub.2N.sup.-) and tris(trifluoromethylsulfonyl)methide ((CF.sub.3SO.sub.2).sub.3C.sup.-). Electroluminescent, electrochromic and photoelectrochromic devices with nanostructured electrodes include ionic liquids with bifunctional redox dyes.

  19. Modeling Liquid-Liquid Equilibrium of Ionic Liquid Systems with NRTL, Electrolyte-NRTL, and UNIQUAC

    E-Print Network [OSTI]

    Stadtherr, Mark A.

    Modeling Liquid-Liquid Equilibrium of Ionic Liquid Systems with NRTL, Electrolyte-NRTL, and UNIQUAC different excess Gibbs free energy models are evaluated: the NRTL, UNIQUAC and electrolyte- NRTL (eNRTL) models. In the case of eNRTL, a new formulation of the model is used, based on a symmetric reference

  20. Soft ionization of thermally evaporated hypergolic ionic liquid aerosols

    SciTech Connect (OSTI)

    University of California; ERC, Incorporated, Edwards Air Force Base; Air Force Research Laboratory, Edwards Air Force Base; National Synchrotron Radiation Research Center (NSRRC); Institute of Chemistry, Hebrew University; Koh, Christine J.; Liu, Chen-Lin; Harmon, Christopher W.; Strasser, Daniel; Golan, Amir; Kostko, Oleg; Chambreau, Steven D.; Vaghjiani, Ghanshyam L.; Leone, Stephen R.

    2011-07-19T23:59:59.000Z

    Isolated ion pairs of a conventional ionic liquid, 1-Ethyl-3-Methyl-Imidazolium Bis(trifluoromethylsulfonyl)imide ([Emim+][Tf2N?]), and a reactive hypergolic ionic liquid, 1-Butyl-3-Methyl-Imidazolium Dicyanamide ([Bmim+][Dca?]), are generated by vaporizing ionic liquid submicron aerosol particles for the first time; the vaporized species are investigated by dissociative ionization with tunable vacuum ultraviolet (VUV) light, exhibiting clear intact cations, Emim+ and Bmim+, presumably originating from intact ion pairs. Mass spectra of ion pair vapor from an effusive source of the hypergolic ionic liquid show substantial reactive decomposition due to the internal energy of the molecules emanating from the source. Photoionization efficiency curves in the near threshold ionization region of isolated ion pairs of [Emim+][Tf2N?]ionic liquid vapor are compared for an aerosol source and an effusive source, revealing changes in the appearance energy due to the amount of internal energy in the ion pairs. The aerosol source has a shift to higher threshold energy (~;;0.3 eV), attributed to reduced internal energy of the isolated ion pairs. The method of ionic liquid submicron aerosol particle vaporization, for reactive ionic liquids such as hypergolic species, is a convenient, thermally ?cooler? source of isolated intact ion pairs in the gas phase compared to effusive sources.

  1. Soft ionization of thermally evaporated hypergolic ionic liquid aerosols

    SciTech Connect (OSTI)

    University of California; ERC, Incorporated, Edwards Air Force Base; Air Force Research Laboratory, Edwards Air Force Base; National Synchrotron Radiation Research Center (NSRRC); Koh, Christine J.; Liu, Chen-Lin; Harmon, Christopher W.; Strasser, Daniel; Golan, Amir; Kostko, Oleg; Chambreau, Steven D.; L.Vaghjiani, Ghanshyam; Leone, Stephen R.

    2012-03-16T23:59:59.000Z

    Isolated ion pairs of a conventional ionic liquid, 1-Ethyl-3-Methyl-Imidazolium Bis(trifluoromethylsulfonyl)imide ([Emim+][Tf2N?]), and a reactive hypergolic ionic liquid, 1- Butyl-3-Methyl-Imidazolium Dicyanamide ([Bmim+][Dca?]), are generated by vaporizing ionic liquid submicron aerosol particles for the first time; the vaporized species are investigated by dissociative ionization with tunable vacuum ultraviolet (VUV) light, exhibiting clear intact cations, Emim+ and Bmim+, presumably originating from intact ion pairs. Mass spectra of ion pair vapor from an effusive source of the hypergolic ionic liquid show substantial reactive decomposition due to the internal energy of the molecules emanating from the source. Photoionization efficiency curves in the near threshold ionization region of isolated ion pairs of [Emim+][Tf2N?] ionic liquid vapor are compared for an aerosol source and an effusive source, revealing changes in the appearance energy due to the amount of internal energy in the ion pairs. The aerosol source has a shift to higher threshold energy (~;;0.3 eV), attributed to reduced internal energy of the isolated ion pairs. The method of ionic liquid submicron aerosol particle vaporization, for reactive ionic liquids such as hypergolic species, is a convenient, thermally ?cooler? source of isolated intact ion pairs in the gas phase compared to effusive sources.

  2. Ion transport and storage of ionic liquids in ionic polymer conductor network composites

    E-Print Network [OSTI]

    Heflin, Randy

    , have shown a great promise for ap- plications in energy storage, conversion devices, and otherIon transport and storage of ionic liquids in ionic polymer conductor network composites Yang Liu,1, USA 6 Department of Chemistry, Virginia Tech, Blacksburg, Virginia 24061, USA Received 24 February

  3. Development of Practical Supported Ionic Liquid Membranes: A Systematic Approach

    SciTech Connect (OSTI)

    Luebke, D.R.; Ilconich, J.B.; Myers, C.R.; Pennline, H.W.

    2007-11-01T23:59:59.000Z

    Supported liquid membranes (SLMs) are a class of materials that allow the researcher to utilize the wealth of knowledge available on liquid properties to optimize membrane performance. These membranes also have the advantage of liquid phase diffusivities, which are higher than those observed in polymers and grant proportionally greater permeabilities. The primary shortcoming of the supported liquid membranes demonstrated in past research has been the lack of stability caused by volatilization of the transport liquid. Ionic liquids, which may possess high CO2 solubility relative to light gases such as H2, are excellent candidates for this type of membrane since they are stable at elevated temperatures and have negligible vapor pressure. A study has been conducted evaluating the use of a variety of ionic liquids in supported ionic liquid membranes for the capture of CO2 from streams containing H2. In a joint project, researchers at the University of Notre Dame synthesized and characterized ionic liquids, and researchers at the National Energy Technology Laboratory incorporated candidate ionic liquids into supports and evaluated membrane performance for the resulting materials. Several steps have been taken in the development of practical supported ionic liquid membranes. Proof-of-concept was established by showing that ionic liquids could be used as the transport media in SLMs. Results showed that ionic liquids are suitable media for gas transport, but the preferred polymeric supports were not stable at temperatures above 135oC. The use of cross-linked nylon66 supports was found to produce membranes mechanically stable at temperatures exceeding 300oC but CO2/H2 selectivity was poor. An ionic liquid whose selectivity does not decrease with increasing temperature was needed, and a functionalized ionic liquid that complexes with CO2 was used. An increase in CO2/H2 selectivity with increasing temperature over the range of 37 to 85oC was observed and the dominance of a facilitated transport mechanism established. The presentation will detail membrane development, the effect of increasing transmembrane pressure, and preliminary results dealing with other gas pairs and contaminants.

  4. Phase-Changing Ionic Liquids: CO2 Capture with Ionic Liquids Involving Phase Change

    SciTech Connect (OSTI)

    None

    2010-07-01T23:59:59.000Z

    IMPACCT Project: Notre Dame is developing a new CO2 capture process that uses special ionic liquids (ILs) to remove CO2 from the gas exhaust of coal-fired power plants. ILs are salts that are normally liquid at room temperature, but Notre Dame has discovered a new class of ILs that are solid at room temperature and change to liquid when they bind to CO2. Upon heating, the CO2 is released for storage, and the ILs re-solidify and donate some of the heat generated in the process to facilitate further CO2 release. These new ILs can reduce the energy required to capture CO2 from the exhaust stream of a coal-fired power plant when compared to state-ofthe- art technology.

  5. Shear and Extensional Rheology of Cellulose/Ionic Liquid Solutions

    E-Print Network [OSTI]

    Haward, Simon J.

    In this study, we characterize the shear and extensional rheology of dilute to semidilute solutions of cellulose in the ionic liquid 1-ethyl-3-methylimidazolium acetate (EMIAc). In steady shear flow, the semidilute solutions ...

  6. Ionic Liquids as Novel Lubricant Additives for Next-Generation...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Ionic Liquids as Novel Lubricant Additives for Next-Generation Fuel-Efficient Engines May 15 2015 10:00 AM - 11:00 AM Jun Qu, Materials Science and Technology Division ORNL...

  7. Molecular Dynamics Modeling of Ionic Liquids in Electrospray Propulsion

    E-Print Network [OSTI]

    . Lozano June 2010 SSL # 6-10 #12;#12;Molecular Dynamics Modeling of Ionic Liquids in Electrospray Propulsion Nanako Takahashi, Paulo C. Lozano June 2010 SSL # 6-10 This work is based on the unaltered text

  8. Kinetics and Solvent Effects in the Synthesis of Ionic Liquids

    E-Print Network [OSTI]

    Schleicher, Jay C.

    2007-12-12T23:59:59.000Z

    Ionic liquids (ILs) are being recognized as environmentally friendly ("green") solvents. However, their synthesis is often conducted in the very solvents that they will reportedly replace. This research has investigated the kinetics and solvent...

  9. The radiation chemistry of ionic liquids: a review

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Mincher, Bruce J.; Wishart, James F.

    2014-07-03T23:59:59.000Z

    Ionic liquids have received increasing attention as media for radiochemical separations. Recent literature includes examinations of the efficiencies and mechanisms of the solvent extraction of lanthanides, actinides and fission products into ionic liquid solutions. For radiochemical applications, including as replacement solvents for nuclear fuel reprocessing, a thorough understanding of the radiation chemistry of ionic liquids will be required. Such an understanding can be achieved based upon a combination of steady-state radiolysis experiments coupled with post-irradiation product identification and pulse-radiolysis experiments to acquire kinetic information. These techniques allow for the elucidation of radiolytic mechanisms. This contribution reviews the current ionic liquid radiation chemistry literature as it affects separations, with these considerations in mind.

  10. Membrane contactor assisted extraction/reaction process employing ionic liquids

    DOE Patents [OSTI]

    Lin, Yupo J. (Naperville, IL); Snyder, Seth W. (Lincolnwood, IL)

    2012-02-07T23:59:59.000Z

    The present invention relates to a functionalized membrane contactor extraction/reaction system and method for extracting target species from multi-phase solutions utilizing ionic liquids. One preferred embodiment of the invented method and system relates to an extraction/reaction system wherein the ionic liquid extraction solutions act as both extraction solutions and reaction mediums, and allow simultaneous separation/reactions not possible with prior art technology.

  11. Ionic liquids and electrochemistry: from proteins to electrochromic devices.

    SciTech Connect (OSTI)

    Keizer, T. S. (Timothy S.); McCleskey, T. M. (Thomas Mark); Baker, G. A. (Gary A.); Burrell, A. K. (Anthony K.); Baker, S. N. (Sheila N.); Warner, B. P. (Benjamin P.); Hall, S. B. (Simon B.)

    2004-01-01T23:59:59.000Z

    We will report on a wide range of activities within the chemistry division at Los Alamos National Laboratory. Results on basic and applied research involving electrochemistry will be discussed. Topics will include electrochemistry of proteins, sensors based on electrochemical signals, temperature sensors, electrochromic devices in ionic liquids and the characterization of organic cation radicals. We have recently developed several applications in ionic liquids that include electrochromic devices, temperature sensors and chemical sensors. The electrochromic windows are being marketed as selftinting automotive mirrors. The ionic liquid based temperature sensor is stable and accurate over a wide range and has the potential to provide high-resolution temperature imaging. Chemical sensors have been developed that use electrochemistry to detect low levels of potential chemical agents in air. We have also studied the basic chemistry of charge transfer complexes and proteins in ionic liquids. Charge transfer complexes display unique behavior in ionic liquid compare to traditional solvents. Proteins can be solubilized at high levels that make it possible to probe electrochemistry in the proper ionic liquid.

  12. Carbon Dioxide Separation with Supported Ionic Liquid Membranes

    SciTech Connect (OSTI)

    Luebke, D.R.; Ilconich, J.B.; Myers, C.R.; Pennline, H.W.

    2007-04-01T23:59:59.000Z

    Supported liquid membranes are a class of materials that allow the researcher to utilize the wealth of knowledge available on liquid properties as a direct guide in the development of a capture technology. These membranes also have the advantage of liquid phase diffusivities higher than those observed in polymeric membranes which grant proportionally greater permeabilities. The primary shortcoming of the supported liquid membranes demonstrated in past research has been the lack of stability caused by volatilization of the transport liquid. Ionic liquids, which possess high carbon dioxide solubility relative to light gases such as hydrogen, are an excellent candidate for this type of membrane since they have negligible vapor pressure and are not susceptible to evaporation. A study has been conducted evaluating the use of several ionic liquids, including 1-hexyl-3-methyl-imidazolium bis(trifuoromethylsulfonyl)imide, 1-butyl-3-methyl-imidazolium nitrate, and 1-ethyl-3-methyl-imidazolium sulfate in supported ionic liquid membranes for the capture of carbon dioxide from streams containing hydrogen. In a joint project, researchers at the University of Notre Dame lent expertise in ionic liquid synthesis and characterization, and researchers at the National Energy Technology Laboratory incorporated candidate ionic liquids into supports and evaluated the resulting materials for membrane performance. Initial results have been very promising with carbon dioxide permeabilities as high as 950 barrers and significant improvements in carbon dioxide/hydrogen selectivity over conventional polymers at 37C and at elevated temperatures. Results include a comparison of the performance of several ionic liquids and a number of supports as well as a discussion of innovative fabrication techniques currently under development.

  13. Method and apparatus using an active ionic liquid for algae biofuel harvest and extraction

    DOE Patents [OSTI]

    Salvo, Roberto Di; Reich, Alton; Dykes, Jr., H. Waite H.; Teixeira, Rodrigo

    2012-11-06T23:59:59.000Z

    The invention relates to use of an active ionic liquid to dissolve algae cell walls. The ionic liquid is used to, in an energy efficient manner, dissolve and/or lyse an algae cell walls, which releases algae constituents used in the creation of energy, fuel, and/or cosmetic components. The ionic liquids include ionic salts having multiple charge centers, low, very low, and ultra low melting point ionic liquids, and combinations of ionic liquids. An algae treatment system is described, which processes wet algae in a lysing reactor, separates out algae constituent products, and optionally recovers the ionic liquid in an energy efficient manner.

  14. The radiation chemistry of ionic liquids: a review

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Mincher, Bruce J.; Wishart, James F.

    2014-07-03T23:59:59.000Z

    Ionic liquids have received increasing attention as media for radiochemical separations. Recent literature includes examinations of the efficiencies and mechanisms of the solvent extraction of lanthanides, actinides and fission products into ionic liquid solutions. For radiochemical applications, including as replacement solvents for nuclear fuel reprocessing, a thorough understanding of the radiation chemistry of ionic liquids will be required. Such an understanding can be achieved based upon a combination of steady-state radiolysis experiments coupled with post-irradiation product identification and pulse-radiolysis experiments to acquire kinetic information. These techniques allow for the elucidation of radiolytic mechanisms. This contribution reviews the current ionic liquidmore »radiation chemistry literature as it affects separations, with these considerations in mind.« less

  15. Carbon Dioxide Separation with Supported Ionic Liquid Membranes

    SciTech Connect (OSTI)

    Luebke, D.R.; Ilconich, J.B.; Pennline, H.W.; Myers, C.R.

    2007-05-01T23:59:59.000Z

    A practical form of CO2 capture at water-gas shift conditions in the IGCC process could serve the dual function of producing a pure CO2 stream for sequestration and forcing the equilibrium-limited shift reaction to completion enriching the stream in H2. The shift temperatures, ranging from the low temperature shift condition of 260°C to the gasification condition of 900°C, limit capture options by diminishing associative interactions which favor removal of CO2 from the gas stream. Certain sorption interactions, such as carbonate formation, remain available but generally involve exceptionally high sorbent regeneration energies that contribute heavily to parasitic power losses. Carbon dioxide selective membranes need only establish an equilibrium between the gas phase and sorption states in order to transport CO2, giving them a potential energetic advantage over other technologies. Supported liquid membranes take advantage of high, liquid phase diffusivities and a solution diffusion mechanism similar to that observed in polymeric membranes to achieve superior permeabilities and selectivites. The primary shortcoming of the supported liquid membranes demonstrated in past research has been the lack of stability caused by volatilization of the transport liquid. Ionic liquids, which possess high CO2 solubility relative to light gases such as H2, are excellent candidates for this type of membrane since they have negligible vapor pressure and are not susceptible to evaporation. A study has been conducted evaluating the use of ionic liquids including 1-hexyl-3-methyl-imidazolium bis(trifuoromethylsulfonyl)imide in supported ionic liquid membranes for the capture of CO2 from streams containing H2. In a joint project, researchers at the University of Notre Dame synthesized and characterized ionic liquids, and researchers at the National Energy Technology Laboratory incorporated candidate ionic liquids into supports and evaluated the resulting materials for membrane performance. Improvements to the ionic liquid and support have allowed testing of these supported ionic liquid membranes at temperatures up to 300°C without loss of support mechanical stability or degradation of the ionic liquid. Substantial improvements in selectivity have also been observed at elevated temperature with the best membrane currently achieving optimum performance at 75°C.

  16. Physicochemical properties and toxicities of hydrophobicpiperidinium and pyrrolidinium ionic liquids

    SciTech Connect (OSTI)

    Salminen, Justin; Papaiconomou, Nicolas; Kumar, R. Anand; Lee,Jong-Min; Kerr, John; Newman, John; Prausnitz, John M.

    2007-06-25T23:59:59.000Z

    Some properties are reported for hydrophobic ionic liquids (IL) containing 1-methyl-1-propyl pyrrolidinium [MPPyrro]{sup +}, 1-methyl-1-butyl pyrrolidinium [MBPyrro]{sup +}, 1-methyl-1-propyl piperidinium [MPPip]{sup +}, 1-methyl-1-butyl piperidinium [MBPip]{sup +}, 1-methyl-1-octylpyrrolidinium [MOPyrro]{sup +} and 1-methyl-1-octylpiperidinium [MOPip]{sup +} cations. These liquids provide new alternatives to pyridinium and imidazolium ILs. High thermal stability of an ionic liquid increases safety in applications like rechargeable lithium-ion batteries and other electrochemical devices. Thermal properties, ionic conductivities, viscosities, and mutual solubilities with water are reported. In addition, toxicities of selected ionic liquids have been measured using a human cancer cell-line. The ILs studied here are sparingly soluble in water but hygroscopic. We show some structure-property relationships that may help to design green solvents for specific applications. While ionic liquids are claimed to be environmentally-benign solvents, as yet few data have been published to support these claims.

  17. Methods for separating medical isotopes using ionic liquids

    DOE Patents [OSTI]

    Luo, Huimin; Boll, Rose Ann; Bell, Jason Richard; Dai, Sheng

    2014-10-21T23:59:59.000Z

    A method for extracting a radioisotope from an aqueous solution, the method comprising: a) intimately mixing a non-chelating ionic liquid with the aqueous solution to transfer at least a portion of said radioisotope to said non-chelating ionic liquid; and b) separating the non-chelating ionic liquid from the aqueous solution. In preferred embodiments, the method achieves an extraction efficiency of at least 80%, or a separation factor of at least 1.times.10.sup.4 when more than one radioisotope is included in the aqueous solution. In particular embodiments, the method is applied to the separation of medical isotopes pairs, such as Th from Ac (Th-229/Ac-225, Ac-227/Th-227), or Ra from Ac (Ac-225 and Ra-225, Ac-227 and Ra-223), or Ra from Th (Th-227 and Ra-223, Th-229 and Ra-225).

  18. Sum frequency generation study on the orientation of room-temperature ionic liquid at the grapheneionic liquid interface

    E-Print Network [OSTI]

    Bao, Jiming

    such as dye-sensitized solar cells and super capacitors, room-temperature ionic liquids are considered

  19. Energy Efficient Electrochromic Windows Incorporating Ionic Liquids

    SciTech Connect (OSTI)

    Cheri Boykin; James Finley; Donald Anthony; Julianna Knowles; Richard Markovic; Michael Buchanan; Mary Ann Fuhry; Lisa Perrine

    2008-11-30T23:59:59.000Z

    One approach to increasing the energy efficiency of windows is to control the amount of solar radiation transmitted through a window by using electrochromic technology. What is unique about this project is that the electrochromic is based on the reduction/oxidation reactions of cathodic and anodic organic semi-conducting polymers using room temperature ionic liquids as ion transport electrolytes. It is believed that these types of coatings would be a lower cost alternative to traditional all inorganic thin film based electrochromic technologies. Although there are patents1 based on the proposed technology, it has never been reduced to practice and thoroughly evaluated (i.e. durability and performance) in a window application. We demonstrate that by using organic semi-conductive polymers, specific bands of the solar spectrum (specifically visible and near infrared) can be targeted for electrochemical variable transmittance responsiveness. In addition, when the technology is incorporated into an insulating glass unit, the energy parameters such as the solar heat gain coefficient and the light to solar gain ratio are improved over that of a typical insulating glass unit comprised of glass with a low emissivity coating. A minimum of {approx}0.02 quads of energy savings per year with a reduction of carbon emissions for electricity of {approx}320 MKg/yr benefit is achieved over that of a typical insulating glass unit including a double silver low-E coating. Note that these values include a penalty in the heating season. If this penalty is removed (i.e. in southern climates or commercial structures where cooling is predominate year-round) a maximum energy savings of {approx}0.05 quad per year and {approx}801 MKg/yr can be achieved over that of a typical insulating glass unit including a double silver low-E coating. In its current state, the technology is not durable enough for an exterior window application. The primary downfall is that the redox chemistry fails to recover to a bleached state upon exposure to heat and solar radiation while being cycled over time from the bleached to the dark state. Most likely the polymers are undergoing degradation reactions which are accelerated by heat and solar exposure while in either the reduced or oxidized states and the performance of the polymers is greatly reduced over time. For this technology to succeed in an exterior window application, there needs to be more work done to understand the degradation of the polymers under real-life application conditions such as elevated temperatures and solar exposure so that recommendations for improvements in to the overall system can be made. This will be the key to utilizing this type of technology in any future real-life applications.

  20. Charge Transport and Glassy Dynamics in Ionic Liquids

    SciTech Connect (OSTI)

    Sangoro, Joshua R [ORNL; Kremer, Friedrich [University of Leipzig

    2012-01-01T23:59:59.000Z

    Ionic liquids (ILs) exhibit unique features such as low melting points, low vapor pressures, wide liquidus temperature ranges, high thermal stability, high ionic conductivity, and wide electrochemical windows. As a result, they show promise for use in variety of applications: as reaction media, in batteries and supercapacitors, in solar and fuel cells, for electrochemical deposition of metals and semiconductors, for protein extraction and crystallization, and many others. Because of the ease with which they can be supercooled, ionic liquids offer new opportunities to investigate long-standing questions regarding the nature of the dynamic glass transition and its possible link to charge transport. Despite the significant steps achieved from experimental and theoretical studies, no generally accepted quantitative theory of dynamic glass transition to date has been capable of reproducing all the experimentally observed features. In this Account, we discuss recent studies of the interplay between charge transport and glassy dynamics in ionic liquids as investigated by a combination of several experimental techniques including broadband dielectric spectroscopy, pulsed field gradient nuclear magnetic resonance, dynamic mechanical spectroscopy, and differential scanning calorimetry. Based on EinsteinSmoluchowski relations, we use dielectric spectra of ionic liquids to determine diffusion coefficients in quantitative agreement with independent pulsed field gradient nuclear magnetic resonance measurements, but spanning a broader range of more than 10 orders of magnitude. This approach provides a novel opportunity to determine the electrical mobility and effective number density of charge carriers as well as their types of thermal activation from the measured dc conductivity separately. We also unravel the origin of the remarkable universality of charge transport in different classes of glass-forming ionic liquids.

  1. Growth of flower-like CdSe dendrites from a Brnsted acidbase ionic liquid precursor{

    E-Print Network [OSTI]

    Utrecht, Universiteit

    solution of water, ethanol and ionic liquid based on formic acid and N,N-dimethylformamide. Experimental, ethanol, an ionic liquid based on formic acid and N,N-dimethylformamide, cadmium chloride and sel

  2. Characterization of an iodine-based ionic liquid ion source and studies on ion fragmentation

    E-Print Network [OSTI]

    Fedkiw, Timothy Peter

    2010-01-01T23:59:59.000Z

    Electrosprays are a well studied source of charged droplets and ions. A specific subclass is the ionic liquid ion source (ILIS), which produce ion beams from the electrostatically stressed meniscus of ionic liquids. ILIS ...

  3. Dynamics in Organic Ionic Liquids in Distinct Regions Using Charged and Uncharged Orientational Relaxation Probes

    E-Print Network [OSTI]

    Fayer, Michael D.

    Dynamics in Organic Ionic Liquids in Distinct Regions Using Charged and Uncharged Orientational probe molecules display markedly different rotational dynamics when analyzed using Stokes increasingly subslip as the length of ionic liquid alkyl chain is increased. The dynamics approach those

  4. Fabrication of fiber supported ionic liquids and methods of use

    DOE Patents [OSTI]

    Luebke, David R; Wickramanayake, Shan

    2013-02-26T23:59:59.000Z

    One or more embodiments relates to the production of a fabricated fiber having an asymmetric polymer network and having an immobilized liquid such as an ionic liquid within the pores of the polymer network. The process produces the fabricated fiber in a dry-wet spinning process using a homogenous dope solution, providing significant advantage over current fabrication methods for liquid-supporting polymers. The fabricated fibers may be effectively utilized for the separation of a chemical species from a mixture based on the selection of the polymer, the liquid, and the solvent utilized in the dope.

  5. Method for synthesis of titanium dioxide nanotubes using ionic liquids

    DOE Patents [OSTI]

    Qu, Jun; Luo, Huimin; Dai, Sheng

    2013-11-19T23:59:59.000Z

    The invention is directed to a method for producing titanium dioxide nanotubes, the method comprising anodizing titanium metal in contact with an electrolytic medium containing an ionic liquid. The invention is also directed to the resulting titanium dioxide nanotubes, as well as devices incorporating the nanotubes, such as photovoltaic devices, hydrogen generation devices, and hydrogen detection devices.

  6. High performance batteries with carbon nanomaterials and ionic liquids

    DOE Patents [OSTI]

    Lu, Wen (Littleton, CO)

    2012-08-07T23:59:59.000Z

    The present invention is directed to lithium-ion batteries in general and more particularly to lithium-ion batteries based on aligned graphene ribbon anodes, V.sub.2O.sub.5 graphene ribbon composite cathodes, and ionic liquid electrolytes. The lithium-ion batteries have excellent performance metrics of cell voltages, energy densities, and power densities.

  7. Electrochemical Generation of Superoxide in Room-Temperature Ionic Liquids

    E-Print Network [OSTI]

    Weidner, John W.

    with an inorganic salt.7 They are directly related to more familiar high-temperature molten salts that are used by the reduction of dioxygen in imidizalium chloride-aluminum chloride molten salt. However, the resulting su and chlorides.2,3,6 Room-temperature ionic liquids RTILs are stable mixtures of an organic cation/anion salt

  8. High performance ultracapacitors with carbon nanomaterials and ionic liquids

    DOE Patents [OSTI]

    Lu, Wen; Henry, Kent Douglas

    2012-10-09T23:59:59.000Z

    The present invention is directed to the use of carbon nanotubes and/or electrolyte structures in various electrochemical devices, such as ultracapacitors having an ionic liquid electrolyte. The carbon nanotubes are preferably aligned carbon nanotubes. Compared to randomly entangled carbon nanotubes, aligned carbon nanotubes can have better defined pore structures and higher specific surface areas.

  9. Ionic Liquid Pretreatment Technologies | Department of Energy

    Office of Environmental Management (EM)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645 3,625 1,006 492 742 33Frequently Asked Questions for DOEtheInspection15 PATRICIA HOFFMANEnergy Investor DealatIonic

  10. Importance of glassy fragility for energy applications of ionic liquids

    E-Print Network [OSTI]

    P. Sippel; P. Lunkenheimer; S. Krohns; E. Thoms; A. Loidl

    2015-02-24T23:59:59.000Z

    Ionic liquids (ILs) are salts that are liquid close to room temperature. Their possible applications are numerous, e.g., as solvents for green chemistry in various electrochemical devices, and even for such "exotic" purposes as spinning-liquid mirrors for lunar telescopes. Here we concentrate on their use for new advancements in energy-storage and -conversion devices: Batteries, supercapacitors or fuel cells using ILs as electrolytes could be important building blocks for the sustainable energy supply of tomorrow. Interestingly, ILs show glassy freezing and the universal, but until now only poorly understood dynamic properties of glassy matter, dominate many of their physical properties. We show that the conductivity of ILs, an essential figure of merit for any electrochemical application, depends in a systematic way not only on their glass temperature but also on the so-called fragility, characterizing the non-canonical super-Arrhenius temperature dependence of their ionic mobility.

  11. Can Ionic Liquids Be Used As Templating Agents For Controlled Design of Uranium-Containing Nanomaterials?

    SciTech Connect (OSTI)

    Visser, A.; Bridges, N.; Tosten, M.

    2013-04-09T23:59:59.000Z

    Nanostructured uranium oxides have been prepared in ionic liquids as templating agents. Using the ionic liquids as reaction media for inorganic nanomaterials takes advantage of the pre-organized structure of the ionic liquids which in turn controls the morphology of the inorganic nanomaterials. Variation of ionic liquid cation structure was investigated to determine the impact on the uranium oxide morphologies. For two ionic liquid cations, increasing the alkyl chain length increases the aspect ratio of the resulting nanostructured oxides. Understanding the resulting metal oxide morphologies could enhance fuel stability and design.

  12. Reduction of Metal Oxide to Metal using Ionic Liquids

    SciTech Connect (OSTI)

    Dr. Ramana Reddy

    2012-04-12T23:59:59.000Z

    A novel pathway for the high efficiency production of metal from metal oxide means of electrolysis in ionic liquids at low temperature was investigated. The main emphasis was to eliminate the use of carbon and high temperature application in the reduction of metal oxides to metals. The emphasis of this research was to produce metals such as Zn, and Pb that are normally produced by the application of very high temperatures. The reduction of zinc oxide to zinc and lead oxide to lead were investigated. This study involved three steps in accomplishing the final goal of reduction of metal oxide to metal using ionic liquids: 1) Dissolution of metal oxide in an ionic liquid, 2) Determination of reduction potential using cyclic voltammetry (CV) and 3) Reduction of the dissolved metal oxide. Ionic liquids provide additional advantage by offering a wide potential range for the deposition. In each and every step of the process, more than one process variable has been examined. Experimental results for electrochemical extraction of Zn from ZnO and Pb from PbO using eutectic mixtures of Urea ((NH2)2CO) and Choline chloride (HOC2H4N(CH3)3+Cl-) or (ChCl) in a molar ratio 2:1, varying voltage and temperatures were carried out. Fourier Transform Infra-Red (FTIR) spectroscopy studies of ionic liquids with and without metal oxide additions were conducted. FTIR and induction coupled plasma spectroscopy (ICPS) was used in the characterization of the metal oxide dissolved ionic liquid. Electrochemical experiments were conducted using EG&G potentiostat/galvanostat with three electrode cell systems. Cyclic voltammetry was used in the determination of reduction potentials for the deposition of metals. Chronoamperometric experiments were carried out in the potential range of -0.6V to -1.9V for lead and -1.4V to -1.9V for zinc. The deposits were characterized using XRD and SEM-EDS for phase, morphological and elemental analysis. The results showed that pure metal was deposited on the cathode. Successful extraction of metal from metal oxide dissolved in Urea/ChCl (2:1) was accomplished. The current efficiencies were relatively high in both the metal deposition processes with current efficiency greater than 86% for lead and 95% for zinc. This technology will advance the metal oxide reduction process by increasing the process efficiency and also eliminate the production of CO2 which makes this an environmentally benign technology for metal extraction.

  13. Ionic liquids for separation of olefin-paraffin mixtures

    DOE Patents [OSTI]

    Dai, Sheng; Luo, Huimin; Huang, Jing-Fang

    2013-09-17T23:59:59.000Z

    The invention is directed to an ionic liquid comprising (i) a cationic portion containing a complex of a silver (I) ion and one or more neutral ligands selected from organoamides, organoamines, olefins, and organonitriles, and (ii) an anionic portion having the chemical formula ##STR00001## wherein m and n are independently 0 or an integer of 1 or above, and p is 0 or 1, provided that when p is 0, the group --N--SO.sub.2--(CF.sub.2).sub.nCF.sub.3 subtended by p is replaced with an oxide atom connected to the shown sulfur atom. The invention is also directed to a method for separating an olefin from an olefin-paraffin mixture by passing the mixture through a layer of the ionic liquid described above.

  14. Ionic liquids for separation of olefin-paraffin mixtures

    DOE Patents [OSTI]

    Dai, Sheng; Luo, Huimin; Huang, Jing-Fang

    2014-07-15T23:59:59.000Z

    The invention is directed to an ionic liquid comprising (i) a cationic portion containing a complex of a silver (I) ion and one or more neutral ligands selected from organoamides, organoamines, olefins, and organonitriles, and (ii) an anionic portion having the chemical formula ##STR00001## wherein m and n are independently 0 or an integer of 1 or above, and p is 0 or 1, provided that when p is 0, the group --N--SO.sub.2--(CF.sub.2).sub.nCF.sub.3 subtended by p is replaced with an oxide atom connected to the shown sulfur atom. The invention is also directed to a method for separating an olefin from an olefin-paraffin mixture by passing the mixture through a layer of the ionic liquid described above.

  15. Ionic liquid-induced synthesis of selenium nanoparticles

    SciTech Connect (OSTI)

    Langi, Bhushan [Changu Kana Thakur Research Centre, New Panvel 410 206 (India)] [Changu Kana Thakur Research Centre, New Panvel 410 206 (India); Shah, Chetan; Singh, Krishankant [Radiation and Photochemistry Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India)] [Radiation and Photochemistry Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India); Chaskar, Atul, E-mail: achaskar@rediffmail.com [Changu Kana Thakur Research Centre, New Panvel 410 206 (India)] [Changu Kana Thakur Research Centre, New Panvel 410 206 (India); Kumar, Manmohan; Bajaj, Parma N. [Radiation and Photochemistry Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India)] [Radiation and Photochemistry Division, Bhabha Atomic Research Centre, Trombay, Mumbai 400 085 (India)

    2010-06-15T23:59:59.000Z

    A simple wet chemical method has been used to synthesize selenium nanoparticles by the reaction of ionic liquid with sodium selenosulphate, a selenium precursor, in the presence of polyvinyl alcohol stabilizer, in aqueous medium. The method is capable of producing spherical selenium nanoparticles in the size range of 76-150 nm under ambient conditions. This is a first report on the production of nano-selenium assisted by an ionic liquid. The synthesized nanoparticles can be separated easily from the aqueous sol by a high-speed centrifuge machine, and can be re-dispersed in an aqueous medium. The synthesized selenium nanoparticles have been characterized by X-ray diffraction, energy dispersive X-ray analysis, differential scanning calorimetry and transmission electron microscopy techniques.

  16. Extraordinarily Efficient Conduction in a Redox-Active Ionic Liquid

    E-Print Network [OSTI]

    Verner K. Thorsmølle; Guido Rothenberger; Daniel Topgaard; Jan C. Brauer; Dai-Bin Kuang; Shaik M. Zakeeruddin; Björn Lindman; Michael Grätzel; Jacques-E. Moser

    2010-11-09T23:59:59.000Z

    Iodine added to iodide-based ionic liquids leads to extraordinarily efficient charge transport, vastly exceeding that expected for such viscous systems. Using terahertz time-domain spectroscopy, in conjunction with dc conductivity, diffusivity and viscosity measurements we unravel the conductivity pathways in 1-methyl-3-propylimidazolium iodide melts. This study presents evidence of the Grotthuss mechanism as a significant contributor to the conductivity, and provides new insights into ion pairing processes as well as the formation of polyiodides. The terahertz and transport results are reunited in a model providing a quantitative description of the conduction by physical diffusion and the Grotthuss bond-exchange process. These novel results are important for the fundamental understanding of conduction in molten salts and for applications where ionic liquids are used as charge-transporting media such as in batteries and dye-sensitized solar cells.

  17. Carbon films produced from ionic liquid carbon precursors

    DOE Patents [OSTI]

    Dai, Sheng; Luo, Huimin; Lee, Je Seung

    2013-11-05T23:59:59.000Z

    The invention is directed to a method for producing a film of porous carbon, the method comprising carbonizing a film of an ionic liquid, wherein the ionic liquid has the general formula (X.sup.+a).sub.x(Y.sup.-b).sub.y, wherein the variables a and b are, independently, non-zero integers, and the subscript variables x and y are, independently, non-zero integers, such that ax=by, and at least one of X.sup.+ and Y.sup.- possesses at least one carbon-nitrogen unsaturated bond. The invention is also directed to a composition comprising a porous carbon film possessing a nitrogen content of at least 10 atom %.

  18. The use of ionic liquid ion sources (ILIS) in FIB applications

    E-Print Network [OSTI]

    Zorzos, Anthony Nicholas

    2009-01-01T23:59:59.000Z

    A new monoenergetic, high-brightness ion source can be constructed using an arrangement similar to liquid metal ion sources (LMIS) by substituting the liquid metal with an ionic liquid, or room temperature molten salt. Ion ...

  19. Synthesis and characterization of new class of ionic liquids containing phenolate anion

    SciTech Connect (OSTI)

    Lethesh, Kallidanthiyil Chellappan, E-mail: lethesh.chellappan@petronas.com.my [PETRONAS Ionic Liquids Center, Universiti Teknologi PETRONAS (Malaysia); Wilfred, Cecilia Devi; Taha, M. F. [Department of Chemical Engineering, Universiti Teknologi PETRONAS (Malaysia); Thanabalan, M. [Fundamental and Applied Sciences, Universiti Teknologi PETRONAS (Malaysia)

    2014-10-24T23:59:59.000Z

    In these manuscript novel ionic liquids containing a new class of 'phenolate' anions was synthesized and characterized. 1-methylmidazole with different alkyl chains such as butyl, hexyl and octyl groups was used as the cationic part. All the ionic liquids were obtained as liquids at room temperature. The synthesized ionic liquids were characterized using {sup 1}H NMR and {sup 13}C NMR spectroscopy. The thermal stability of the ionic liquids was studied using thermo gravimetric analysis (TGA). The effect of temperature on the density and viscosity of the ionic liquids were studied over a temperature range from 293.15 K to 373.15K at atmospheric pressure. From the experimental values of density, the molecular volume, standard molar entropy and the lattice energy of the ionic liquids were calculated.

  20. Synthesis and Characterization of Thiazolium-Based Room Temperature Ionic Liquids for Gas Separations

    SciTech Connect (OSTI)

    Hillesheim, Patrick C [ORNL; Mahurin, Shannon Mark [ORNL; Fulvio, Pasquale F [ORNL; Yeary, Joshua S [ORNL; Oyola, Yatsandra [ORNL; Jiang, Deen [ORNL; Dai, Sheng [ORNL

    2012-01-01T23:59:59.000Z

    A series of novel thiazolium-bis(triflamide) based ionic liquids has been synthesized and characterized. Physicochemical properties of the ionic liquids such as thermal stability, phase transitions, and infrared spectra were analysed and compared to the imidazolium-based congeners. Several unique classes of ancillary substitutions are examined with respect to impacts on overall structure, in addition to their carbon dioxide absorption properties in supported ionic-liquid membranes for gas separation.

  1. E-Print Network 3.0 - ammonium ionic liquids Sample Search Results

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Atomic Data Center (CFADC) Collection: Plasma Physics and Fusion 2 "Control of protein folding and misfolding in ionic liquid media, and a conjecture on early earth biology"....

  2. Methods of using ionic liquids having a fluoride anion as solvents

    DOE Patents [OSTI]

    Pagoria, Philip (Livermore, CA); Maiti, Amitesh (San Ramon, CA); Gash, Alexander (Brentwood, CA); Han, Thomas Yong (Pleasanton, CA); Orme, Christine (Oakland, CA); Fried, Laurence (Livermore, CA)

    2011-12-06T23:59:59.000Z

    A method in one embodiment includes contacting a strongly hydrogen bonded organic material with an ionic liquid having a fluoride anion for solubilizing the strongly hydrogen bonded organic material; and maintaining the ionic liquid at a temperature of about 90.degree. C. or less during the contacting. A method in another embodiment includes contacting a strongly hydrogen bonded organic material with an ionic liquid having an acetate or formate anion for solubilizing the strongly hydrogen bonded organic material; and maintaining the ionic liquid at a temperature of less than about 90.degree. C. during the contacting.

  3. Regenerating cellulose from ionic liquids for an accelerated enzymatic hydrolysis

    SciTech Connect (OSTI)

    Zhao, Hua [Savannah State University; Jones, Cecil L [Savannah State University; Baker, Gary A [ORNL; Xia, Shuqian [Tianjin University, Tianjin, China; Olubajo, Olarongbe [Savannah State University; Person, Vernecia [Savannah State University

    2009-01-01T23:59:59.000Z

    The efficient conversion of lignocellulosic materials into fuel ethanol has become a research priority in producing affordable and renewable energy. The pretreatment of lignocelluloses is known to be key to the fast enzymatic hydrolysis of cellulose. Recently, certain ionic liquids (ILs)were found capable of dissolving more than 10 wt% cellulose. Preliminary investigations [Dadi, A.P., Varanasi, S., Schall, C.A., 2006. Enhancement of cellulose saccharification kinetics using an ionic liquid pretreatment step. Biotechnol. Bioeng. 95, 904 910; Liu, L., Chen, H., 2006. Enzymatic hydrolysis of cellulose materials treated with ionic liquid [BMIM]Cl. Chin. Sci. Bull. 51, 2432 2436; Dadi, A.P., Schall, C.A., Varanasi, S., 2007. Mitigation of cellulose recalcitrance to enzymatic hydrolysis by ionic liquid pretreatment. Appl. Biochem. Biotechnol. 137 140, 407 421] suggest that celluloses regenerated from IL solutions are subject to faster saccharification than untreated substrates. These encouraging results offer the possibility of using ILs as alternative and nonvolatile solvents for cellulose pretreatment. However, these studies are limited to two chloride-based ILs: (a) 1-butyl-3-methylimidazolium chloride ([BMIM]Cl), which is a corrosive, toxic and extremely hygroscopic solid (m.p. 70 C), and (b) 1-allyl-3-methylimidazolium chloride ([AMIM]Cl), which is viscous and has a reactive side-chain. Therefore, more in-depth research involving other ILs is much needed to explore this promising pretreatment route. For this reason, we studied a number of chloride- and acetate-based ILs for cellulose regeneration, including several ILs newly developed in our laboratory. This will enable us to select inexpensive, efficient and environmentally benign solvents for processing cellulosic biomass. Our data confirm that all regenerated celluloses are less crystalline (58 75% lower) and more accessible to cellulase (>2 times) than untreated substrates. As a result, regenerated Avicel cellulose, filter paper and cottonwere hydrolyzed 2 10 times faster than the respective untreated celluloses. A complete hydrolysis of Avicel cellulose could be achieved in 6 h given the Trichoderma reesei cellulase/substrate ratio (w/w) of 3:20 at 50 C. In addition,we observed that cellulase is more thermally stable (up to 60 C) in the presence of regenerated cellulose. Furthermore, our systematic studies suggest that the presence of various ILs during the hydrolysis induced different degrees of cellulase inactivation. Therefore, a thorough removal of IL residues after cellulose regeneration is highly recommended, and a systematic investigation on this subject is much needed.

  4. Hydrogen Fluoride Capture by Imidazolium Acetate Ionic Liquid

    E-Print Network [OSTI]

    Chaban, Vitaly

    2015-01-01T23:59:59.000Z

    Extraction of hydrofluoric acid (HF) from oils is a drastically important problem in petroleum industry, since HF causes quick corrosion of pipe lines and brings severe health problems to humanity. Some ionic liquids (ILs) constitute promising scavenger agents thanks to strong binding to polar compounds and tunability. PM7-MD simulations and hybrid density functional theory are employed here to consider HF capture ability of ILs. Discussing the effects and impacts of the cation and the anion separately and together, I will evaluate performance of imidazolium acetate and outline systematic search guidelines for efficient adsorption and extraction of HF.

  5. Polarizability effects on the structure and dynamics of ionic liquids

    SciTech Connect (OSTI)

    Cavalcante, Ary de Oliveira, E-mail: arycavalcante@ufam.edu.br [Institute of Chemistry, University of Campinas – UNICAMP, Cx. P. 6154, Campinas, SP 13084-862 (Brazil); Departamento de Química, Universidade Federal do Amazonas, Av. Rodrigo Octávio, 6200, Coroado, Manaus, AM (Brazil); Ribeiro, Mauro C. C. [Laboratório de Espectroscopia Molecular, Instituto de Química, Universidade de São Paulo, São Paulo, SP C.P. 26077, 05513 970 São Paulo, SP (Brazil)] [Laboratório de Espectroscopia Molecular, Instituto de Química, Universidade de São Paulo, São Paulo, SP C.P. 26077, 05513 970 São Paulo, SP (Brazil); Skaf, Munir S. [Institute of Chemistry, University of Campinas – UNICAMP, Cx. P. 6154, Campinas, SP 13084-862 (Brazil)] [Institute of Chemistry, University of Campinas – UNICAMP, Cx. P. 6154, Campinas, SP 13084-862 (Brazil)

    2014-04-14T23:59:59.000Z

    Polarization effects on the structure and dynamics of ionic liquids are investigated using molecular dynamics simulations. Four different ionic liquids were simulated, formed by the anions Cl{sup ?} and PF{sub 6}{sup ?}, treated as single fixed charge sites, and the 1-n-alkyl-3-methylimidazolium cations (1-ethyl and 1-butyl-), which are polarizable. The partial charge fluctuation of the cations is provided by the electronegativity equalization model (EEM) and a complete parameter set for the cations electronegativity (?) and hardness (J) is presented. Results obtained from a non-polarizable model for the cations are also reported for comparison. Relative to the fixed charged model, the equilibrium structure of the first solvation shell around the imidazolium cations shows that inclusion of EEM polarization forces brings cations closer to each other and that anions are preferentially distributed above and below the plane of the imidazolium ring. The polarizable model yields faster translational and reorientational dynamics than the fixed charges model in the rotational-diffusion regime. In this sense, the polarizable model dynamics is in better agreement with the experimental data.

  6. Using Ionic Liquids in Selective Hydrocarbon Conversion Processes

    SciTech Connect (OSTI)

    Tang, Yongchun; Periana, Roy; Chen, Weiqun; van Duin, Adri; Nielsen, Robert; Shuler, Patrick; Ma, Qisheng; Blanco, Mario; Li, Zaiwei; Oxgaard, Jonas; Cheng, Jihong; Cheung, Sam; Pudar, Sanja

    2009-09-28T23:59:59.000Z

    This is the Final Report of the five-year project Using Ionic Liquids in Selective Hydrocarbon Conversion Processes (DE-FC36-04GO14276, July 1, 2004- June 30, 2009), in which we present our major accomplishments with detailed descriptions of our experimental and theoretical efforts. Upon the successful conduction of this project, we have followed our proposed breakdown work structure completing most of the technical tasks. Finally, we have developed and demonstrated several optimized homogenously catalytic methane conversion systems involving applications of novel ionic liquids, which present much more superior performance than the Catalytica system (the best-to-date system) in terms of three times higher reaction rates and longer catalysts lifetime and much stronger resistance to water deactivation. We have developed in-depth mechanistic understandings on the complicated chemistry involved in homogenously catalytic methane oxidation as well as developed the unique yet effective experimental protocols (reactors, analytical tools and screening methodologies) for achieving a highly efficient yet economically feasible and environmentally friendly catalytic methane conversion system. The most important findings have been published, patented as well as reported to DOE in this Final Report and our 20 Quarterly Reports.

  7. Development of an Ionic-Liquid Absorption Heat Pump

    SciTech Connect (OSTI)

    Holcomb, Don

    2011-03-29T23:59:59.000Z

    Solar Fueled Products (SFP) is developing an innovative ionic-liquid absorption heat pump (ILAHP). The development of an ILAHP is extremely significant, as it could result in annual savings of more than 190 billion kW h of electrical energy and $19 billion. This absorption cooler uses about 75 percent less electricity than conventional cooling and heating units. The ILAHP also has significant environmental sustainability benefits, due to reduced CO2 emissions. Phase I established the feasibility and showed the economic viability of an ILAHP with these key accomplishments: • Used the breakthrough capabilities provided by ionic liquids which overcome the key difficulties of the common absorption coolers. • Showed that the theoretical thermodynamic performance of an ILAHP is similar to existing absorption-cooling systems. • Established that the half-effect absorption cycle reduces the peak generator temperature, improving collector efficiency and reducing collector area. • Component testing demonstrated that the most critical components, absorber and generator, operate well with conventional heat exchangers. • Showed the economic viability of an ILAHP. The significant energy savings, sustainability benefits, and economic viability are compelling reasons to continue the ILAHP development.

  8. Interactions of Ionic Liquids with Uranium and its Bioreduction

    SciTech Connect (OSTI)

    Zhang, C.; Francis, A.

    2012-09-18T23:59:59.000Z

    We investigated the influence of ionic liquids (ILs) 1-butyl-3-methylimidazolium hexafluorophosphate [BMIM]{sup +}[PF{sub 6}]{sup -}, N-ethylpyridinium trifluoroacetate [EtPy]{sup +}[CF{sub 3}COO]{sup -} and N-ethylpyridinium tetrafluoroborate [Et-Py]{sup +}[BF{sub 4}]{sup -} on uranium reduction by Clostridium sp. under anaerobic conditions. Potentiometric titration, UV-vis spectrophotometry, LC-MS and EXAFS analyses showed monodentate complexation between uranyl and BF{sub 4}{sup -} PF{sub 6}{sup -}; and bidentate complexation with CF{sub 3}COO{sup -}. Ionic liquids affected the growth of Clostridium sp. as evidenced by decrease in optical density, changes in pH, gas production, and the extent of U(VI) reduction and precipitation of U(IV) from solution. Reduction of U(VI) to U(IV) was observed in the presence of [EtPy][BF{sub 4}] and [BMIM][PF{sub 6}] but not with [EtPy][CF{sub 3}COO].

  9. Metal-air cell comprising an electrolyte with a room temperature ionic liquid and hygroscopic additive

    DOE Patents [OSTI]

    Friesen, Cody A.; Krishnan, Ramkumar; Tang, Toni; Wolfe, Derek

    2014-08-19T23:59:59.000Z

    An electrochemical cell comprising an electrolyte comprising water and a hydrophobic ionic liquid comprising positive ions and negative ions. The electrochemical cell also includes an air electrode configured to absorb and reduce oxygen. A hydrophilic or hygroscopic additive modulates the hydrophobicity of the ionic liquid to maintain a concentration of the water in the electrolyte is between 0.001 mol % and 25 mol %.

  10. Short Communication Bioreduction and precipitation of uranium in ionic liquid aqueous

    E-Print Network [OSTI]

    Ohta, Shigemi

    Short Communication Bioreduction and precipitation of uranium in ionic liquid aqueous solution by Clostridium sp. C. Zhang a,b, , C.J. Dodge c , S.V. Malhotra a,1 , A.J. Francis c,d a Department of Chemistry t s Uranium forms various complexes with ionic liquids. Uranium bioreduction was affected by the type

  11. A disiloxane-functionalized phosphonium-based ionic liquid as electrolyte for lithium-ion batteries

    SciTech Connect (OSTI)

    Weng, Wei [Argonne National Lab. (ANL), Argonne, IL (United States). Chemical Science and Engineering Div.; Zhang, Zhengcheng [Argonne National Lab. (ANL), Argonne, IL (United States). Chemical Science and Engineering Div.; Lu, Jun [Argonne National Lab. (ANL), Argonne, IL (United States). Chemical Science and Engineering Div.; Amine, Khalil [Argonne National Lab. (ANL), Argonne, IL (United States). Chemical Science and Engineering Div.

    2011-01-01T23:59:59.000Z

    A disiloxane-functionalized ionic liquid based on a phosphonium cation and a bis(trifluoromethylsulfonyl)imide (TFSI) anion was synthesized and characterized. This new ionic liquid electrolyte showed good stability with a lithium transition metal oxide cathode and a graphite anode in lithium ion cells.

  12. Method of purifying a gas stream using 1,2,3-triazolium ionic liquids

    DOE Patents [OSTI]

    Luebke, David; Nulwala, Hunald; Tang, Chau

    2014-12-09T23:59:59.000Z

    A method for separating a target gas from a gaseous mixture using 1,2,3-triazolium ionic liquids is presented. Industrial effluent streams may be cleaned by removing carbon dioxide from the stream by contacting the effluent stream with a 1,2,3-triazolium ionic liquid compound.

  13. Department of Energy and Mineral Engineering Spring 2013 Preliminary Plant Design For Bitumen Separation Using Ionic Liquid

    E-Print Network [OSTI]

    Demirel, Melik C.

    For Bitumen Separation Using Ionic Liquid Overview IL Fuels LLC invented a novel way to separate bitumen from of producing 5,000 barrels of bitumen per day while maximizing the recovery of ionic liquid and water of bitumen/day Maintain a maximum of 0.2% loss of ionic liquids to the cleaned sands Improve overall

  14. Tunable wavelength soft photoionization of ionic liquid vapors

    SciTech Connect (OSTI)

    Strasser, Daniel; Goulay, Fabien; Belau, Leonid; Kostko, Oleg; Koh, Christine; Chambreau, Steven D.; Vaghjiani, Ghanshyam L.; Ahmed, Musahid; Leone, Stephen R.

    2009-11-11T23:59:59.000Z

    Combined data of photoelectron spectra and photoionization efficiency curves in the near threshold ionization region of isolated ion-pairs from [emim][Tf2N], [emim][Pf2N]and [dmpim][Tf2N]ionic liquid vapors reveal small shifts in the ionization energies of ion-pair systems due to cation and anion substitutions. Shifts towards higher binding energy following anion substitution are attributed to increased electronegativity of the anion itself, while shifts towards lower binding energies following cation substitution are attributed to an increase in the cation-anion distance that causes a lower Coulombic binding potential. The predominant ionization mechanism in the near threshold photon energy region is identified as dissociative ionization, involving dissociation of the ion-pair and the production of intact cations as the positively charged products.

  15. PilMNOPQ from the Pseudomonas aeruginosa Type IV Pilus System form a Transenvelope1 Protein Interaction Network that Interacts with PilA*

    E-Print Network [OSTI]

    Burrows, Lori

    sub-58 complexes: the cytoplasmic motor subcomplex (consisting of PilB, PilT, PilU, PilCB (pilus62 extension), PilT and PilU (pilus retraction), and the integral membrane protein, PilC

  16. 81891 - A New Class of Solvents for TRU Dissolution and Separation: Ionic Liquids

    SciTech Connect (OSTI)

    Robin D. Rogers

    2004-12-10T23:59:59.000Z

    Through the current EMSP funding, solvent extraction technologies based on liquid-liquid partitioning of TRU to an Ionic Liquid phase containing conventional complexants has been shown to be viable. The growing understanding of the role that the different components of an ionic liquid can have on the partitioning mechanism, and on the nature of the subsequent dissolved species indicates strongly that ionic liquids are not necessarily direct replacements for volatile or otherwise hazardous organic solvents. Separations and partitioning can be exceptionally complex with competing solvent extraction, cation, anion and sacrificial ion exchange mechanisms are all important, depending on the selection of components for formation of the ionic liquid phase, and that control of these competing mechanisms can be utilized to provide new, alternative separations schemes.

  17. Extraction of Biofuels and Biofeedstocks from Aqueous Solutions Using Ionic Liquids

    E-Print Network [OSTI]

    Stadtherr, Mark A.

    Extraction of Biofuels and Biofeedstocks from Aqueous Solutions Using Ionic Liquids Luke D. Simoni-Butanol, Extraction, Liquid-Liquid Equilibrium, Excess Gibbs Energy Models, Biofuels #12;1 1. Introduction other organic compounds can be produced biologically, and thus can be considered as biofuel candidates

  18. Studies of ionic liquids in lithium-ion battery test systems

    E-Print Network [OSTI]

    Salminen, Justin; Prausnitz, John M.; Newman, John

    2006-01-01T23:59:59.000Z

    Studies of ionic liquids in lithium-ion battery test systemsobstacles for their use in lithium-ion batteries. However,devices. For rechargeable lithium-ion batteries, it is

  19. Selective extraction of copper, mercury, silver and palladium ions from water using hydrophobic ionic liquids.

    E-Print Network [OSTI]

    Papaiconomou, Nicolas; Lee, Jong-Min; Salminen, Justin; Von Stosch, Moritz; Prausnitz, John M.

    2008-01-01T23:59:59.000Z

    for metal-ion extraction from water. All ionic liquids (useful for extraction of cations from water. 9-15 Previoussingle extraction of mercury in water with either [3MOPYR

  20. A Microfabricated Planar Electrospray Array Ionic Liquid Ion Source With Integrated Extractor

    E-Print Network [OSTI]

    Gassend, Blaise

    This paper reports the design, fabrication, and experimental characterization of a fully microfabricated planar array of externally fed electrospray emitters that produces heavy molecular ions from the ionic liquids ...

  1. Theoretical Investigations on Nanoporpus Materials and Ionic Liquids for Energy Storage 

    E-Print Network [OSTI]

    Mani Biswas, Mousumi

    2012-02-14T23:59:59.000Z

    . Hydrogen storage in carbon nanotube scaffold. 2. Mechanical property and stability of various nanoporous Metal Organic Frameworks. 3. Thermodynamic and transport properties of [BMIM][BF4] ionic liquid in bulk, in Li Salt mixture, on graphite surface...

  2. Communication: Unusual structure and transport in ionic liquid-hexane mixtures

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Liang, Min [Rutgers Univ., Piscataway, NJ (United States). Dept. of Chemistry and Chemical Biology; Khatun, Sufia [Rutgers Univ., Piscataway, NJ (United States). Dept. of Chemistry and Chemical Biology; Castner, Edward W. [Rutgers Univ., Piscataway, NJ (United States). Dept. of Chemistry and Chemical Biology

    2015-03-28T23:59:59.000Z

    Ionic liquids having a sufficiently amphiphilic cation can dissolve large volume fractions of alkanes, leading to mixtures with intriguing properties on molecular length scales. The trihexyl(tetradecyl)phosphonium cation paired with the bis(trifluoromethylsulfonyl)amide anion provides an ionic liquid that can dissolve large mole fractions of hexane. We present experimental results on mixtures of n-C6D14 with this ionic liquid. High- energy X-ray scattering studies reveal a persistence of the characteristic features of ionic liquid structure even for 80% dilution with n-C6D14. NMR self-diffusion results reveal decidedly non-hydrodynamic behavior where the self-diffusion of the neutral, non-polar n-C6D14 is on average a factor of 21 times faster than for the cation. Exploitation of the unique structural and transport properties of these mixtures may lead to new opportunities for designer solvents for enhanced chemical reactivity and interface science.

  3. High Temperature/Low Humidity Polymer Electrolytes Derived from Ionic Liquids

    Broader source: Energy.gov [DOE]

    Presentation on High Temperature/Low Humidity Polymer Electrolytes Derived from Ionic Liquids to the High Temperature Membrane Working Group Meeting held in Arlington, Virginia, May 26,2005.

  4. Environmentally Benign Production of Ionic Liquids in CO2-Expanded Systems

    E-Print Network [OSTI]

    Nwosu, Sylvia Ogechi

    2012-08-31T23:59:59.000Z

    The need to reduce air pollution in chemical manufacturing processes continues to drive the search for alternative solvents. Ionic Liquids (ILs) have emerged in recent years as a promising solution. In contrast to traditional ...

  5. 81929 - Fission-Product Separation Based on Room - Temperature Ionic Liquids

    SciTech Connect (OSTI)

    Robin D. Rogers

    2004-12-09T23:59:59.000Z

    This project has demonstrated that Sr2+ and Cs+ can be selectively extracted from aqueous solutions into ionic liquids using crown ethers and that unprecedented large distribution coefficients can be achieved for these fission products. The volume of secondary wastes can be significantly minimized with this new separation technology. Through the current EMSP funding, the solvent extraction technology based on ionic liquids has been shown to be viable and can potentially provide the most efficient separation of problematic fission products from high level wastes. The key results from the current funding period are the development of highly selective extraction process for cesium ions based on crown ethers and calixarenes, optimization of selectivities of extractants via systematic change of ionic liquids, and investigation of task-specific ionic liquids incorporating both complexant and solvent characteristics.

  6. Carbon dioxide separation through supported ionic liquids membranes in polymeric matrixes

    SciTech Connect (OSTI)

    Ilconich, J.B.; Luebke, D.R.; Myers, C.R.; Pennline, H.W

    2006-09-01T23:59:59.000Z

    As compared to other gas separation techniques, membranes have several advantages which can include low capital cost, relatively low energy usage and scalability. While it could be possible to synthesize the ideal polymer for membrane separation of carbon dioxide from fuel gas, it would be very intensive in terms of money and time. Supported liquid membranes allow the researcher to utilize the wealth of knowledge available on liquid properties. Ionic liquids, which can be useful in capturing CO2 from fuel gas because they posses high CO2 solubility in the ionic liquid relative to H2, are an excellent candidate for this type of membrane. Ionic liquids are not susceptible to evaporation due to their negligible vapor pressure and thus eliminate the main problem typically seen with supported liquid membranes. A study has been conducted evaluating the use of the ionic liquid 1-hexyl-3-methyl-imidazolium bis(trifuoromethylsulfonyl)imide in supported ionic liquid membranes for the capture of CO2 from streams containing H2. In a joint project, the ionic liquid was synthesized and characterized at the University of Notre Dame, incorporated into a polymeric matrix, and tested at the National Energy Technology Laboratory. Initial results have been very promising with calculated CO2 permeabilities as high as 950 barrers and significant improvements in CO2/H2 selectivity over the unmodified polymer at 37 oC along with promising results at elevated temperatures. In addition to performance, the study included examining the choice of polymeric supports on performance and membrane stability in more realistic operating conditions. Also included in this study was an evaluation of novel approaches to incorporate the ionic liquid into polymer matrices to optimize the performance and stability of the membranes.

  7. Temperature dependence of some liquid lithium properties from the ionic pseudopotential

    E-Print Network [OSTI]

    Engel, Anthony Wells

    1977-01-01T23:59:59.000Z

    OF SCIEECE May 1977 Ma)or Sub)ect: Mnclear Engineering TEMPERATURE DEPENDENCE OP SOME LIQUID LITHIUM PROPERTIES PROM THE IONIC PSEUDOPOTENTIAL A Thesis by ANTHONY WELLS ENGEL Approved as to style and content by: ea o spar men em er em er May 1977... ABSTRACT Temperature Dependence of Some Liquid Lithium Properties from the Ionic Pseudopotential. (May 1977) Anthony Wells Engely A B y Rutgers University Chairman of Advisory Committee: Dr. Henri R. Ieribaux The purpose of this investigation...

  8. Elucidating graphene - Ionic Liquid interfacial region: a combined experimental and computational study

    SciTech Connect (OSTI)

    Vijayakumar, M.; Schwenzer, Birgit; Shutthanandan, V.; Hu, Jian Z.; Liu, Jun; Aksay, Ilhan A.

    2014-01-10T23:59:59.000Z

    The interfacial region between graphene and an imidazolium based ionic liquid is studied using spectroscopic analysis and computational modelling. This combined approach reveals that the molecular level structure of the interfacial region is significantly influenced by functional group defects on the graphene surface.The combined experimental and computational study reveals that the molecular structure at interfacial region between graphene and imidazolium based ionic liquid is defined by the hydroxyl functional groups on the graphene surface

  9. Complex Capacitance Scaling in Ionic Liquids-Filled Nanopores

    SciTech Connect (OSTI)

    Sumpter, Bobby G [ORNL

    2011-01-01T23:59:59.000Z

    Recent experiments have shown that the capacitance of subnanometer pores increases anomalously as the pore width decreases, thereby opening a new avenue for developing supercapacitors with enhanced energy density. However, this behavior is still subject to some controversy since its physical origins are not well understood. Using atomistic simulations, we show that the capacitance of slit-shaped nanopores in contact with room-temperature ionic liquids exhibits a U-shaped scaling behavior in pores with widths from 0.75 to 1.26 nm. The left branch of the capacitance scaling curve directly corresponds to the anomalous capacitance increase and thus reproduces the experimental observations. The right branch of the curve indirectly agrees with experimental findings that so far have received little attention. The overall U-shaped scaling behavior provides insights on the origins of the difficulty in experimentally observing the pore-width-dependent capacitance. We establish a theoretical framework for understanding the capacitance of electrical double layers in nanopores and provide mechanistic details into the origins of the observed scaling behavior. The framework highlights the critical role of 'ion solvation' in controlling pore capacitance and the importance of choosing anion/cation couples carefully for optimal energy storage in a given pore system.

  10. Complex Capacitance Scaling in Ionic Liquids-filled Nanopores

    SciTech Connect (OSTI)

    Qiao, Rui [Clemson University; Huang, Jingsong [ORNL; Meunier, Vincent [ORNL; Sumpter, Bobby G [ORNL; Peng, Wu [Clemson University

    2011-01-01T23:59:59.000Z

    Recent experiments have shown that the capacitance of sub-nanometer pores increases anomalously as the pore width decreases, thereby opening a new avenue for developing supercapacitors with enhanced energy density. However, this behavior is still subject to some controversy since its physical origins are not well understood. Using atomistic simulations, we show that the capacitance of slit-shaped nanopores in contact with room-temperature ionic liquids exhibits a U-shaped scaling behavior in pores with width from 0.75 to 1.26 nm. The left branch of the capacitance scaling curve directly corresponds to the anomalous capacitance increase and thus reproduces the experimental observations. The right branch of the curve indirectly agrees with experimental findings that so far have received little attention. The overall U-shaped scaling behavior provides insights on the origins of the difficulty in experimentally observing the pore-width dependent capacitance. We establish a theoretical framework for understanding the capacitance of electrical double layers in nanopores and provide mechanistic details into the origins of the observed scaling behavior. The framework highlights the critical role of ion solvation in controlling pore capacitance and the importance of choosing anion/cation couples carefully for optimal energy storage in a given pore system.

  11. Interfacial Ionic Liquids: Connecting Static and Dynamic Structures

    E-Print Network [OSTI]

    Ahmet Uysal; Hua Zhou; Guang Feng; Sang Soo Lee; Song Li; Peter T. Cummings; Pasquale F. Fulvio; Sheng Dai; John K. McDonough; Yury Gogotsi; Paul Fenter

    2014-12-06T23:59:59.000Z

    It is well-known that room temperature ionic liquids (RTILs) often adopt a charge-separated layered structure, i.e., with alternating cation- and anion-rich layers, at electrified interfaces. However, the dynamic response of the layered structure to temporal variations in applied potential is not well understood. We used in situ, real-time X-ray reflectivity (XR) to study the potential-dependent electric double layer (EDL) structure of an imidazolium-based RTIL on charged epitaxial graphene during potential cycling as a function of temperature. The results suggest that the graphene-RTIL interfacial structure is bistable in which the EDL structure at any intermediate potential can be described by the combination of two extreme-potential structures whose proportions vary depending on the polarity and magnitude of the applied potential. This picture is supported by the EDL structures obtained by fully atomistic molecular dynamics (MD) simulations at various static potentials. The potential-driven transition between the two structures is characterized by an increasing width but with an approximately fixed hysteresis magnitude as a function of temperature. The results are consistent with the coexistence of distinct anion and cation adsorbed structures separated by an energy barrier (~0.15 eV).

  12. Understanding the impact of the central atom on the ionic liquid behavior: Phosphonium vs ammonium cations

    SciTech Connect (OSTI)

    Carvalho, Pedro J.; Ventura, Sónia P. M.; Batista, Marta L. S.; Schröder, Bernd; Coutinho, João A. P., E-mail: jcoutinho@ua.pt [CICECO, Departamento de Química, Universidade de Aveiro, 3810-193 Aveiro (Portugal)] [CICECO, Departamento de Química, Universidade de Aveiro, 3810-193 Aveiro (Portugal); Gonçalves, Fernando [Departamento de Biologia e CESAM (Centro de Estudos do Ambiente e do Mar), Universidade de Aveiro, 3810-193 Aveiro (Portugal)] [Departamento de Biologia e CESAM (Centro de Estudos do Ambiente e do Mar), Universidade de Aveiro, 3810-193 Aveiro (Portugal); Esperança, José [Instituto de Tecnologia Química e Biológica, Universidade Nova de Lisboa, 2780-901 Oeiras (Portugal)] [Instituto de Tecnologia Química e Biológica, Universidade Nova de Lisboa, 2780-901 Oeiras (Portugal); Mutelet, Fabrice [Laboratoire Réactions et Génie des Procédés, CNRS (UPR3349), Nancy-Université, 1 rue Grandville, BP 20451 54001 Nancy (France)] [Laboratoire Réactions et Génie des Procédés, CNRS (UPR3349), Nancy-Université, 1 rue Grandville, BP 20451 54001 Nancy (France)

    2014-02-14T23:59:59.000Z

    The influence of the cation's central atom in the behavior of pairs of ammonium- and phosphonium-based ionic liquids was investigated through the measurement of densities, viscosities, melting temperatures, activity coefficients at infinite dilution, refractive indices, and toxicity against Vibrio fischeri. All the properties investigated are affected by the cation's central atom nature, with ammonium-based ionic liquids presenting higher densities, viscosities, melting temperatures, and enthalpies. Activity coefficients at infinite dilution show the ammonium-based ionic liquids to present slightly higher infinite dilution activity coefficients for non-polar solvents, becoming slightly lower for polar solvents, suggesting that the ammonium-based ionic liquids present somewhat higher polarities. In good agreement these compounds present lower toxicities than the phosphonium congeners. To explain this behavior quantum chemical gas phase DFT calculations were performed on isolated ion pairs at the BP-TZVP level of theory. Electronic density results were used to derive electrostatic potentials of the identified minimum conformers. Electrostatic potential-derived CHelpG and Natural Population Analysis charges show the P atom of the tetraalkylphosphonium-based ionic liquids cation to be more positively charged than the N atom in the tetraalkylammonium-based analogous IL cation, and a noticeable charge delocalization occurring in the tetraalkylammonium cation, when compared with the respective phosphonium congener. It is argued that this charge delocalization is responsible for the enhanced polarity observed on the ammonium based ionic liquids explaining the changes in the thermophysical properties observed.

  13. Ionic Liquids as Novel Lubricants and /or Lubricant Additives

    SciTech Connect (OSTI)

    Qu, J. [ORNL; Viola, M. B. [General Motors Company

    2013-10-31T23:59:59.000Z

    This ORNL-GM CRADA developed ionic liquids (ILs) as novel lubricants or oil additives for engine lubrication. A new group of oil-miscible ILs have been designed and synthesized with high thermal stability, non-corrosiveness, excellent wettability, and most importantly effective anti-scuffing/anti-wear and friction reduction characteristics. Mechanistic analysis attributes the superior lubricating performance of IL additives to their physical and chemical interactions with metallic surfaces. Working with a leading lubricant formulation company, the team has successfully developed a prototype low-viscosity engine oil using a phosphonium-phosphate IL as an anti-wear additive. Tribological bench tests of the IL-additized formulated oil showed 20-33% lower friction in mixed and elastohydrodynamic lubrication and 38-92% lower wear in boundary lubrication when compared with commercial Mobil 1 and Mobil Clean 5W-30 engine oils. High-temperature, high load (HTHL) full-size engine tests confirmed the excellent anti-wear performance for the IL-additized engine oil. Sequence VID engine dynamometer tests demonstrated an improved fuel economy by >2% for this IL-additized engine oil benchmarked against the Mobil 1 5W-30 oil. In addition, accelerated catalyst aging tests suggest that the IL additive may potentially have less adverse impact on three-way catalysts compared to the conventional ZDDP. Follow-on research is needed for further development and optimization of IL chemistry and oil formulation to fully meet ILSAC GF-5 specifications and further enhance the automotive engine efficiency and durability.

  14. Studies of ionic liquids in lithium-ion battery test systems

    SciTech Connect (OSTI)

    Salminen, Justin; Prausnitz, John M.; Newman, John

    2006-06-01T23:59:59.000Z

    In this work, thermal and electrochemical properties of neat and mixed ionic liquid - lithium salt systems have been studied. The presence of a lithium salt causes both thermal and phase-behavior changes. Differential scanning calorimeter DSC and thermal gravimetric analysis TGA were used for thermal analysis for several imidazolium bis(trifluoromethylsulfonyl)imide, trifluoromethansulfonate, BF{sub 4}, and PF{sub 6} systems. Conductivities and diffusion coefficient have been measured for some selected systems. Chemical reactions in electrode - ionic liquid electrolyte interfaces were studied by interfacial impedance measurements. Lithium-lithium and lithium-carbon cells were studied at open circuit and a charged system. The ionic liquids studied include various imidazolium systems that are already known to be electrochemically unstable in the presence of lithium metal. In this work the development of interfacial resistance is shown in a Li|BMIMBF{sub 4} + LiBF{sub 4}|Li cell as well as results from some cycling experiments. As the ionic liquid reacts with the lithium electrode the interfacial resistance increases. The results show the magnitude of reactivity due to reduction of the ionic liquid electrolyte that eventually has a detrimental effect on battery performance.

  15. Structure and phase transitions into ionic adsorption layers on liquid interfaces

    E-Print Network [OSTI]

    R. Tsekov

    2014-10-25T23:59:59.000Z

    The structure of ionic adsorption layers is studied via a proper thermodynamic treatment of the electrostatic and non-electrostatic interactions between the surfactant ions as well as of the effect of thermodynamic non-locality. The analysis is also applied to phase transitions into the ionic adsorption layer, which interfere further with the oscillatory-diffusive structure of the electric double layer and hydrodynamic stability of squeezing waves in thin liquid films.

  16. Carbon Dioxide Selective Supported Ionic Liquid Membranes: The Effect of Contaminants

    SciTech Connect (OSTI)

    Luebke, D.R.; Ilconich, J.B.; Myers, C.R.; Pennline, H.W.

    2008-04-01T23:59:59.000Z

    The integrated gasification combined cycle (IGCC) is widely viewed as a promising technology for the large scale production of energy in a carbon constrained world. These cycles, which include gasification, contaminant removal, water-gas shift, CO2 capture and compression, and combustion of the reduced-carbon fuel gas in a turbine, often have significant efficiency advantages over conventional combustion technologies. A CO2 selective membrane capable of maintaining performance at conditions approaching those of low temperature water-gas shift (260oC) could facilitate the production of carbon-neutral energy by simultaneously driving the shift reaction to completion and concentrating CO2 for sequestration. Supported ionic liquid membranes (SILMs) have been previously evaluated for this application and determined to be physically and chemically stable to temperatures in excess of 300oC. These membranes were based on ionic liquids which interacted physically with CO2 and diminished considerably in selectivity at higher temperatures. To alleviate this problem, the original ionic liquids were replaced with ionic liquids able to form chemical complexes with CO2. These complexing ionic liquid membranes have a local maximum in selectivity which is observed at increasing temperatures for more stable complexes. Efforts are currently underway to develop ionic liquids with selectivity maxima at temperatures greater than 75oC, the best result to date, but other practical concerns must also be addressed if the membrane is to be realistically expected to function under water-gas shift conditions. A CO2 selective membrane must function not only at high temperature, but also in the presence of all the reactants and contaminants likely to be present in coal-derived fuel gas, including water, CO, and H2S. A study has been undertaken which examines the effects of each of these gases on both complexing and physically interacting supported liquid membranes. In a joint project, researchers at the University of Notre Dame synthesized and characterized ionic liquids, and researchers at the National Energy Technology Laboratory incorporated candidate ionic liquids into supports and evaluated the resulting materials for membrane performance.

  17. High Temperature Separation of Carbon Dioxide/Hydrogen Mixtures Using Facilitated Supported Ionic Liquid Membranes

    SciTech Connect (OSTI)

    Myers, C.R.; Pennline, H.W.; Luebke, D.R.; Ilconich, J.B.; Dixon, J.K. (Univ. of Notre Dame, Notre Dame, IN); Maginn, E.J. (Univ. of Notre Dame, Notre Dame, IN); Brennecke, J.F. (Univ. of Notre Dame, Notre Dame, IN)

    2008-09-01T23:59:59.000Z

    Efficiently separating CO2 from H2 is one of the key steps in the environmentally responsible uses of fossil fuel for energy production. A wide variety of resources, including petroleum coke, coal, and even biomass, can be gasified to produce syngas (a mixture of COand H2). This gas stream can be further reacted with water to produce CO2 and more H2. Once separated, the CO2 can be stored in a variety of geological formations or sequestered by other means. The H2 can be combusted to operate a turbine, producing electricity, or used to power hydrogen fuel cells. In both cases, onlywater is produced as waste. An amine functionalized ionic liquid encapsulated in a supported ionic liquid membrane (SILM) can separate CO2 from H2 with a higher permeability and selectivity than any known membrane system. This separation is accomplished at elevated temperatures using facilitated transport supported ionic liquid membranes.

  18. Catalytic Conversion of Biomass to Fuels and Chemicals Using Ionic Liquids

    SciTech Connect (OSTI)

    Liu, Wei; Zheng, Richard; Brown, Heather; Li, Joanne; Holladay, John; Cooper, Alan; Rao, Tony; ,

    2012-04-13T23:59:59.000Z

    This project provides critical innovations and fundamental understandings that enable development of an economically-viable process for catalytic conversion of biomass (sugar) to 5-hydroxymethylfurfural (HMF). A low-cost ionic liquid (Cyphos 106) is discovered for fast conversion of fructose into HMF under moderate reaction conditions without any catalyst. HMF yield from fructose is almost 100% on the carbon molar basis. Adsorbent materials and adsorption process are invented and demonstrated for separation of 99% pure HMF product and recovery of the ionic liquid from the reaction mixtures. The adsorbent material appears very stable in repeated adsorption/regeneration cycles. Novel membrane-coated adsorbent particles are made and demonstrated to achieve excellent adsorption separation performances at low pressure drops. This is very important for a practical adsorption process because ionic liquids are known of high viscosity. Nearly 100% conversion (or dissolution) of cellulose in the catalytic ionic liquid into small molecules was observed. It is promising to produce HMF, sugars and other fermentable species directly from cellulose feedstock. However, several gaps were identified and could not be resolved in this project. Reaction and separation tests at larger scales are needed to minimize impacts of incidental errors on the mass balance and to show 99.9% ionic liquid recovery. The cellulose reaction tests were troubled with poor reproducibility. Further studies on cellulose conversion in ionic liquids under better controlled conditions are necessary to delineate reaction products, dissolution kinetics, effects of mass and heat transfer in the reactor on conversion, and separation of final reaction mixtures.

  19. Gelled Ionic Liquid-Based Membranes: Achieving a 10,000 GPU Permeance for Post-Combustion Carbon Capture with Gelled Ionic Liquid-Based Membranes

    SciTech Connect (OSTI)

    None

    2011-02-02T23:59:59.000Z

    IMPACCT Project: Alongside Los Alamos National Laboratory and the Electric Power Research Institute, CU-Boulder is developing a membrane made of a gelled ionic liquid to capture CO2 from the exhaust of coal-fired power plants. The membranes are created by spraying the gelled ionic liquids in thin layers onto porous support structures using a specialized coating technique. The new membrane is highly efficient at pulling CO2 out of coal-derived flue gas exhaust while restricting the flow of other materials through it. The design involves few chemicals or moving parts and is more mechanically stable than current technologies. The team is now working to further optimize the gelled materials for CO2 separation and create a membrane layer that is less than 1 micrometer thick.

  20. Ionic liquids and ionic liquid acids with high temperature stability for fuel cell and other high temperature applications, method of making and cell employing same

    DOE Patents [OSTI]

    Angell, C. Austen (Mesa, AZ); Xu, Wu (Broadview Heights, OH); Belieres, Jean-Philippe (Chandler, AZ); Yoshizawa, Masahiro (Tokyo, JP)

    2011-01-11T23:59:59.000Z

    Disclosed are developments in high temperature fuel cells including ionic liquids with high temperature stability and the storage of inorganic acids as di-anion salts of low volatility. The formation of ionically conducting liquids of this type having conductivities of unprecedented magnitude for non-aqueous systems is described. The stability of the di-anion configuration is shown to play a role in the high performance of the non-corrosive proton-transfer ionic liquids as high temperature fuel cell electrolytes. Performance of simple H.sub.2(g) electrolyte/O.sub.2(g) fuel cells with the new electrolytes is described. Superior performance both at ambient temperature and temperatures up to and above 200.degree. C. are achieved. Both neutral proton transfer salts and the acid salts with HSO.sup.-.sub.4 anions, give good results, the bisulphate case being particularly good at low temperatures and very high temperatures. The performance of all electrolytes is improved by the addition of a small amount of involatile base of pK.sub.a value intermediate between those of the acid and base that make the bulk electrolyte. The preferred case is the imidazole-doped ethylammonium hydrogensulfate which yields behavior superior in all respects to that of the industry standard phosphoric acid electrolyte.

  1. Towards In situ extraction of fine chemicals and biorenewable fuels from fermentation broths using Ionic liquids and the Intensification of contacting by the application of Electric Fields

    E-Print Network [OSTI]

    Gangu, Satya Aravind

    2013-05-31T23:59:59.000Z

    and design new ionic liquids for task specific needs. Solvent selection for in situ fermentation is depended on high solute partitioning and their biocompatibility with the microorganisms. Such information for these new set of solvents, ionic liquids...

  2. Electrochemical Polishing Applications and EIS of a Novel Choline Chloride-Based Ionic Liquid

    SciTech Connect (OSTI)

    Wixtrom, Alex I. [Christopher Newport University, Newport News, VA (United States); Buhler, Jessica E. [Christopher Newport University, Newport News, VA (United States); Reece, Charles E. [Thomas Jefferson National Accelerator Facility, Newport News, VA (United States); Abdel-Fattah, Tarek M. [Christopher Newport University, Newport News, VA (United States)

    2013-06-01T23:59:59.000Z

    Minimal surface roughness is a critical feature for high-field superconducting radio frequency (SRF) cavities used to engineer particle accelerators. Current methods for polishing Niobium cavities typically utilize solutions containing a mixture of concentrated sulfuric and hydrofluoric acid. Polishing processes such as these are effective, yet there are many hazards and costs associated with the use (and safe disposal) of the concentrated acid solutions. An alternative method for electrochemical polishing of the cavities was explored using a novel ionic liquid solution containing choline chloride. Potentiostatic electrochemical impedance spectroscopy (EIS) was used to analyze the ionic polishing solution. Final surface roughness of the Nb was found to be comparable to that of the acid-polishing method, as assessed by atomic force microscopy (AFM). This indicates that ionic liquid-based electrochemical polishing of Nb is a viable replacement for acid-based methods for preparation of SRF cavities.

  3. Anion-driven mesogenicity: ionic liquid crystals based on the [closo-1-Bryan Ringstrand,a

    E-Print Network [OSTI]

    Kaszynski, Piotr

    for their potential applications as electrolytes for e.g. lithium ion batteries. The closest examples of such ILCs been investigated as counterions in ionic liquids29 and for applications as lithium-ion battery interest in developing ion-conduc- tive materials2­6 for applications in batteries7 and dye

  4. Communication: Unusual structure and transport in ionic liquid-hexane mixtures

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Liang, Min; Khatun, Sufia; Castner, Edward W.

    2015-03-28T23:59:59.000Z

    Ionic liquids having a sufficiently amphiphilic cation can dissolve large volume fractions of alkanes, leading to mixtures with intriguing properties on molecular length scales. The trihexyl(tetradecyl)phosphonium cation paired with the bis(trifluoromethylsulfonyl)amide anion provides an ionic liquid that can dissolve large mole fractions of hexane. We present experimental results on mixtures of n-C6D14 with this ionic liquid. High- energy X-ray scattering studies reveal a persistence of the characteristic features of ionic liquid structure even for 80% dilution with n-C6D14. NMR self-diffusion results reveal decidedly non-hydrodynamic behavior where the self-diffusion of the neutral, non-polar n-C6D14 is on average a factor of 21more »times faster than for the cation. Exploitation of the unique structural and transport properties of these mixtures may lead to new opportunities for designer solvents for enhanced chemical reactivity and interface science.« less

  5. Adsorption of imidazolium and pyridinium ionic liquids onto montmorillonite : characterization and thermodynamic calculations

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    1 Adsorption of imidazolium and pyridinium ionic liquids onto montmorillonite : characterization the adsorption of the RTILs through a cation exchange mechanism. Adsorption isotherms, done at pH = 7 and at 25°C, displayed that the maximum adsorption capacity of the substrates was closely linked to the nature

  6. Use of polymer/ionic liquid plasticizers as gel electrolytes in electrochromic devices

    E-Print Network [OSTI]

    Otero, Toribio Fernández

    Use of polymer/ionic liquid plasticizers as gel electrolytes in electrochromic devices H. Bircana polymer configuration is commonly used when constructing electrochromic devices (ECDs) due to the expected)thienyl)-N-methylcarbazole] (PBEDOT-NMCz) as the two complementary electrochromic polymers for the device. A variety of gel

  7. Reverse Atom Transfer Radical Polymerization of Methyl Methacrylate in Room-Temperature Ionic Liquids

    E-Print Network [OSTI]

    Wan, Xin-hua

    , College of Chemistry and Molecular Engineering, Peking University, Beijing 100871, China Received 14, the removal and recycling of the catalytic materials become important. It is expected that using ionic liquids as ATRP media. They performed the copper(I)-mediated ATRP of methyl methacrylate (MMA) in 1-butyl-3

  8. Ionic Liquids as templating agents in formation of uranium-containing nanomaterials

    SciTech Connect (OSTI)

    Visser, Ann E; Bridges, Nicholas J

    2014-06-10T23:59:59.000Z

    A method for forming nanoparticles containing uranium oxide is described. The method includes combining a uranium-containing feedstock with an ionic liquid to form a mixture and holding the mixture at an elevated temperature for a period of time to form the product nanoparticles. The method can be carried out at low temperatures, for instance less than about 300.degree. C.

  9. Determination of Binding Constants of Cyclodextrins in Room-Temperature Ionic Liquids

    E-Print Network [OSTI]

    Reid, Scott A.

    unique chemical and physical properties, including being air and moisture stable, a high solubility power with supercritical fluid CO2;9-11 (4) electrochemical reactions;12,13 and (5) as a medium for enzymatic reactions.14Determination of Binding Constants of Cyclodextrins in Room-Temperature Ionic Liquids by Near

  10. Protein Unfolding, and the "Tuning In" of Reversible Intermediate States, in Protic Ionic Liquid Media

    E-Print Network [OSTI]

    Angell, C. Austen

    's heat capacity as it undergoes the unfolding process. This yields a spe- cific enthalpy change, which partial heat capacities, we will simply report the total system heat capacity and attribute the partProtein Unfolding, and the "Tuning In" of Reversible Intermediate States, in Protic Ionic Liquid

  11. A Comparison of Electron-Transfer Dynamics inIonic Liquids and Neutral Solvents

    SciTech Connect (OSTI)

    Wishart J. F.; Lee, H.Y.; Issa, J.B.; Isied, S.S.; Castner, Jr., E.W.; Pan, Y.; Hussey, C.L.; Lee, K.S.

    2012-03-01T23:59:59.000Z

    The effect of ionic liquids on photoinduced electron-transfer reactions in a donor-bridge-acceptor system is examined for two ionic liquid solvents, 1-butyl-1-methylpyrrolidinium bis(trifluoromethylsulfonyl)amide and tributylmethylammonium bis(trifluoromethylsulfonyl)amide. The results are compared with those for the same system in methanol and acetonitrile solution. Electron-transfer rates were measured using time-resolved fluorescence quenching for the donor-bridge-acceptor system comprising a 1-N,1-N-dimethylbenzene-1,4-diamine donor, a proline bridge, and a coumarin 343 acceptor. The photoinduced electron-transfer processes are in the inverted regime (-{Delta}G > {lambda}) in all four solvents, with driving forces of -1.6 to -1.9 eV and estimated reorganization energies of about 1.0 eV. The observed electron-transfer kinetics have broadly distributed rates that are generally slower in the ionic liquids compared to the neutral solvents, which also have narrower rate distributions. To describe the broad distributions of electron-transfer kinetics, we use two different models: a distribution of exponential lifetimes and a discrete sum of exponential lifetimes. Analysis of the donor-acceptor electronic coupling shows that for ionic liquids this intramolecular electron-transfer reaction should be treated using a solvent-controlled electron-transfer model.

  12. Ionic Liquids for Utilization of Waste Heat from Distributed Power Generation Systems

    SciTech Connect (OSTI)

    Joan F. Brennecke; Mihir Sen; Edward J. Maginn; Samuel Paolucci; Mark A. Stadtherr; Peter T. Disser; Mike Zdyb

    2009-01-11T23:59:59.000Z

    The objective of this research project was the development of ionic liquids to capture and utilize waste heat from distributed power generation systems. Ionic Liquids (ILs) are organic salts that are liquid at room temperature and they have the potential to make fundamental and far-reaching changes in the way we use energy. In particular, the focus of this project was fundamental research on the potential use of IL/CO2 mixtures in absorption-refrigeration systems. Such systems can provide cooling by utilizing waste heat from various sources, including distributed power generation. The basic objectives of the research were to design and synthesize ILs appropriate for the task, to measure and model thermophysical properties and phase behavior of ILs and IL/CO2 mixtures, and to model the performance of IL/CO2 absorption-refrigeration systems.

  13. Solubilities of Solutes in Ionic Liquids from a SimplePerturbed-Hard-Sphere Theory

    SciTech Connect (OSTI)

    Qin, Yuan; Prausnitz, John M.

    2005-09-20T23:59:59.000Z

    In recent years, several publications have provided solubilities of ordinary gases and liquids in ionic liquids. This work reports an initial attempt to correlate the experimental data using a perturbed-hard-sphere theory; the perturbation is based on well-known molecular physics when the solution is considered as a dielectric continuum. For this correlation, the most important input parameters are hard-sphere diameters of the solute and of the cation and anion that constitute the ionic liquid. In addition, the correlation uses the solvent density and the solute's polarizability and dipole and quadrupole moments, if any. Dispersion-energy parameters are obtained from global correlation of solubility data. Results are given for twenty solutes in several ionic liquids at normal temperatures; in addition, some results are given for gases in two molten salts at very high temperatures. Because the theory used here is much simplified, and because experimental uncertainties (especially for gaseous solutes) are often large, the accuracy of the correlation presented here is not high; in general, predicted solubilities (Henry's constants) agree with experiment to within roughly {+-} 70%. As more reliable experimental data become available, modifications in the characterizing parameters are likely to improve accuracy. Nevertheless, even in its present form, the correlation may be useful for solvent screening in engineering design.

  14. Gene sequences of the pil operon reveal relationships between symbiotic strains of Vibrio

    E-Print Network [OSTI]

    McFall-Ngai, Margaret

    with the rest of the operon. The pilB, pilC and pilD loci were flanked at the 39 end by yacE, followedB and pilD) are conserved among strains of V. fischeri, but pilC differs in sequence between symbiotic

  15. Gas-liquid critical point in ionic fluids

    E-Print Network [OSTI]

    O. Patsahan; I. Mryglod; T. Patsahan

    2006-06-27T23:59:59.000Z

    Based on the method of collective variables we develop the statistical field theory for the study of a simple charge-asymmetric $1:z$ primitive model (SPM). It is shown that the well-known approximations for the free energy, in particular DHLL and ORPA, can be obtained within the framework of this theory. In order to study the gas-liquid critical point of SPM we propose the method for the calculation of chemical potential conjugate to the total number density which allows us to take into account the higher order fluctuation effects. As a result, the gas-liquid phase diagrams are calculated for $z=2-4$. The results demonstrate the qualitative agreement with MC simulation data: critical temperature decreases when $z$ increases and critical density increases rapidly with $z$.

  16. High-Pressure Phase Equilibria of Ionic Liquids and Compressed Gases for Applications in Reactions and Absorption Refrigeration

    E-Print Network [OSTI]

    Ren, Wei

    2009-12-29T23:59:59.000Z

    for reactions and separations. However, without understanding the phase equilibrium, the kinetics results cannot be properly interpreted. This work also demonstrates that the absorption refrigeration system using ionic liquids and compressed gases in vehicles...

  17. On the identification and mitigation of life-limiting mechanisms of ionic liquid ion sources envisaged for propulsion of microspacecraft

    E-Print Network [OSTI]

    Brikner, Natalya Anna

    2015-01-01T23:59:59.000Z

    Life-limiting processes affecting ionic liquid ion sources (ILIS) are investigated in this research, motivated by the development of ILIS for propulsion of microspacecraft and other industrial applications. Micropropulsion ...

  18. Click grafting of seaweed bioactive polysaccharides onto PVC surfaces using ionic liquid as green solvent and catalyst

    E-Print Network [OSTI]

    Boyer, Edmond

    Click grafting of seaweed bioactive polysaccharides onto PVC surfaces using ionic liquid as green solvent and catalyst Sandra Bigota , Guy Louarnb , Nasreddine Kébir*a and Fabrice Burela a Normandie

  19. An Ionic Liquid Reaction and Separation Process for Production of Hydroxymethylfurfural from Sugars

    SciTech Connect (OSTI)

    Liu, Wei; Zheng, Feng; Li, Joanne; Cooper, Alan R.

    2014-01-01T23:59:59.000Z

    There has been world-wide interest to making plastics out of renewable biomass feedstock for recent years. Hydroxymethylfurfural (HMF) is viewed as an attractive alternate to terephthalic acid (TPA) for production of polyesters (PET) and polyamides. Conversion of sugars into HMF has been studied in numerous publications. In this work, a complete ionic liquid reaction and separation process is presented for nearly stoichiometric conversion of fructose into HMF. Different adsorbent materials are evaluated and silicalite material is demonstrated effective for isolation of 99% pure HMF from actual ionic liquid reaction mixtures and for recovery of the un-converted sugars and reaction intermediate along with the ionic liquid. Membrane-coated silicalite particles are prepared and studied for a practical adsorption process operated at low pressure drops but with separation performances comparable or better than the powder material. Complete conversion of fresh fructose feed into HMF in the recycled ionic liquid is shown under suitable reaction conditions. Stability of HMF product is characterized. A simplified process flow diagram is proposed based on these research results, and the key equipment such as reactor and adsorbent bed is sized for a plant of 200,000 ton/year of fructose processing capacity. The proposed HMF production process is much simpler than the current paraxylene (PX) manufacturing process from petroleum oil, which suggests substantial reduction to the capital cost and energy consumption be possible. At the equivalent value to PX on the molar basis, there can be a large gross margin for HMF production from fructose and/or sugars.

  20. Fabrication of hollow mesoporous NiO hexagonal microspheres via hydrothermal process in ionic liquid

    SciTech Connect (OSTI)

    Zhao, Jinbo, E-mail: zhaojinb@gmail.com [Key Laboratory for Liquid-Solid Structural Evolution and Processing of Materials (Ministry of Education), Shandong University, 250061, Jinan (China) [Key Laboratory for Liquid-Solid Structural Evolution and Processing of Materials (Ministry of Education), Shandong University, 250061, Jinan (China); School of Materials Science and Engineering, Shandong University, 250061, Jinan (China); Wu, Lili, E-mail: wulili@sdu.edu.cn [Key Laboratory for Liquid-Solid Structural Evolution and Processing of Materials (Ministry of Education), Shandong University, 250061, Jinan (China) [Key Laboratory for Liquid-Solid Structural Evolution and Processing of Materials (Ministry of Education), Shandong University, 250061, Jinan (China); School of Materials Science and Engineering, Shandong University, 250061, Jinan (China); Zou, Ke, E-mail: zouk2005@163.com [Key Laboratory for Liquid-Solid Structural Evolution and Processing of Materials (Ministry of Education), Shandong University, 250061, Jinan (China) [Key Laboratory for Liquid-Solid Structural Evolution and Processing of Materials (Ministry of Education), Shandong University, 250061, Jinan (China); School of Materials Science and Engineering, Shandong University, 250061, Jinan (China)

    2011-12-15T23:59:59.000Z

    Highlights: Black-Right-Pointing-Pointer Ni(OH){sub 2} precursors were synthesized in ionic liquid and water solution by hydrothermal method. Black-Right-Pointing-Pointer NiO hollow microspheres were prepared by thermal treatment of Ni(OH){sub 2} precursors. Black-Right-Pointing-Pointer NiO hollow microspheres were self-assembled by mesoporous cubic and hexagonal nanocrystals with high specific surface area. Black-Right-Pointing-Pointer The mesoporous structure is stable at 773 K. Black-Right-Pointing-Pointer The ionic liquid absorbed on the O-terminate surface of the crystals to form hydrogen bond and played key roles in determining the final shape of the NiO novel microstructure. -- Abstract: The novel NiO hexagonal hollow microspheres have been successfully prepared by annealing Ni(OH){sub 2}, which was synthesized via an ionic liquid-assisted hydrothermal method. The samples were characterized by X-ray diffraction (XRD), field emission scanning electron microscope (FE-SEM), transmission electron microscopy (TEM), N{sub 2} adsorption-desorption and Fourier transform infrared spectrometer (FTIR). The results show that the hollow NiO microstructures are self-organized by mesoporous cubic and hexagonal nanocrystals. The mesoporous structure possessed good thermal stability and high specific surface area (ca. 83 m{sup 2}/g). The ionic liquid 1-butyl-3methylimidazolium tetrafluoroborate ([Bmim][BF{sub 4}]) was found to play a key role in controlling the morphology of NiO microstructures during the hydrothermal process. The special hollow mesoporous architectures will have potential applications in many fields, such as catalysts, absorbents, sensors, drug-delivery carriers, acoustic insulators and supercapacitors.

  1. Direct exfoliation of natural graphite into micrometer size few layers graphene sheets using ionic liquids

    SciTech Connect (OSTI)

    Wang, X.; Fulvio, P. F.; Baker, G. A.; Veith, G. M.; Unocic, R. R.; Mahurin, S., M.; Chi, M.; Dai, S.

    2010-01-01T23:59:59.000Z

    Stable high-concentration suspensions (up to 0.95 mg mL{sup ?1}) of non-oxidized few layer graphene (FLG), five or less sheets, with micrometre-long edges were obtained via direct exfoliation of natural graphite flakes in ionic liquids, such as 1-butyl-3-methyl-imidazolium bis(trifluoro-methane-sulfonyl)imide ([Bmim]-[Tf{sub 2}N]), by tip ultrasonication.

  2. Properties of some ionic liquids based on1-methyl-3-octylimidazolium and 4-methyl-N-butylpyridinium cations.

    SciTech Connect (OSTI)

    Papaiconomou, Nicolas; Yakelis, Neal; Salminen, Justin; Bergman,Robert; Prausnitz, John M.

    2005-09-29T23:59:59.000Z

    Syntheses are reported for ionic liquids containing 1-methyl-3octylimidazolium and 4-methyl-N-butylpyridinium cations, and trifluoromethansulfonate, dicyanamide, bis(trifluoromethylsulfonyl)imide, and nonafluorobutanesulfonate anions. Densities, melting points and glass transition points, solubility in water as well as polarities have been measured. Ionic liquids based on pyridinium cations exhibit higher melting points, lower solubility in water, and higher polarity than those based on imidazolium cations.

  3. Physically and chemically stable ionic liquid-infused textured surfaces showing excellent dynamic omniphobicity

    SciTech Connect (OSTI)

    Miranda, Daniel F.; Urata, Chihiro; Masheder, Benjamin; Dunderdale, Gary J.; Hozumi, Atsushi, E-mail: a.hozumi@aist.go.jp [National Institute of Advanced Industrial Science and Technology (AIST), 2266-98, Anagahora, Shimo-Shidami, Moriyama-ku, Nagoya, Aichi 463-8560 (Japan); Yagihashi, Makoto [Nagoya Municipal Industrial Research Institute, Rokuban, Atsuta-ku, Nagoya 456-0058 (Japan)

    2014-05-01T23:59:59.000Z

    A fluorinated and hydrophobic ionic liquid (IL), 1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl) imide, effectively served as an advantageous lubricating liquid for the preparation of physically and chemically stable omniphobic surfaces based on slippery liquid-infused porous surfaces. Here, we used particulate microstructures as supports, prepared by the chemical vapor deposition of 1,3,5,7-tetramethylcyclotetrasiloxane and subsequent surface modification with (3-aminopropyl)triethoxysilane. Confirmed by SEM and contact angle measurements, the resulting IL-infused microtextured surfaces are smooth and not only water but also various low surface tension liquids can easily slide off at low substrate tilt angles of <5°, even after exposure to high temperature, vacuum, and UV irradiation.

  4. From molten salts to room temperature ionic liquids: Simulation studies on chloroaluminate systems

    E-Print Network [OSTI]

    Salanne, Mathieu; Seitsonen, Ari P; Madden, Paul A; Kirchner, Barbara; 10.1039/C1FD00053E

    2013-01-01T23:59:59.000Z

    An interaction potential including chloride anion polarization effects, constructed from first-principles calculations, is used to examine the structure and transport properties of a series of chloroaluminate melts. A particular emphasis was given to the study of the equimolar mixture of aluminium chloride with 1-ethyl-3-methylimidazolium chloride, which forms a room temperature ionic liquid EMI-AlCl 4. The structure yielded by the classical simulations performed within the framework of the polarizable ion model is compared to the results obtained from entirely electronic structure-based simulations: An excellent agreement between the two flavors of molecular dynamics is observed. When changing the organic cation EMI+ by an inorganic cation with a smaller ionic radius (Li+, Na+, K+), the chloroaluminate speciation becomes more complex, with the formation of Al2Cl 7- in small amounts. The calculated transport properties (diffusion coefficients, electrical conductivity and viscosity) of EMI-AlCl4 are in good ag...

  5. Pysico-chemical properties of hydrophobic ionic liquids containing 1-octylpyridinium, 1-octyl-2-methylpyridinium or 1-octyl-4-methylpyridinium cations

    E-Print Network [OSTI]

    Papaiconomou, Nicolas; Salminen, Justin; Lee, Jong-Min; Prausnitz, John M.

    2006-01-01T23:59:59.000Z

    P. A. Z. Ionic liquid (molten salt) phase organometallicambient-temperature molten salts. Inorg. Chem. 1996, 35,are room-temperature molten salts with melting points near

  6. Squeezout phenomena and boundary layer formation of a model ionic liquid under confinement and charging

    E-Print Network [OSTI]

    R. Capozza; A. Vanossi; A. Benassi; E. Tosatti

    2014-12-22T23:59:59.000Z

    Electrical charging of parallel plates confining a model ionic liquid down to nanoscale distances yields a variety of charge-induced changes in the structural features of the confined film. That includes even-odd switching of the structural layering and charging-induced solidification and melting, with important changes of local ordering between and within layers, and of squeezout behavior. By means of molecular dynamics simulations, we explore this variety of phenomena in the simplest charged Lennard-Jones coarse-grained model including or excluding the effect a neutral tail giving an anisotropic shape to one of the model ions. Using these models and open conditions permitting the flow of ions in and out of the interplate gap, we simulate the liquid squeezout to obtain the distance dependent structure and forces between the plates during their adiabatic appraoch under load. Simulations at fixed applied force illustrate an effective electrical pumping of the ionic liquid, from a thick nearly solid film that withstands the interplate pressure for high plate charge to complete squeezout following melting near zero charge. Effective enthalpy curves obtained by integration of interplate forces versus distance show the local minima that correspond to layering, and predict the switching between one minimum and another under squeezing and charging.

  7. Reversible Ionic Liquids as Double-Action Solvents for Efficient CO{sub 2} Capture

    SciTech Connect (OSTI)

    Charles Eckert; Charles Liotta

    2011-09-30T23:59:59.000Z

    We have developed a novel class of CO{sub 2} capture solvents, Reversible Ionic Liquids (RevILs), that offer high absorption capacity through two modes of capture: chemical reaction (chemisorption) and physical solubility (physisorption). These solvents are silicon containing alkaline compounds such as silylamines that form a liquid salt (ionic liquid) upon reaction with CO{sub 2}. Subsequently, modest elevations in temperature reverse the reaction and yield pure CO{sub 2} for sequestration. By incorporating Si in the molecules we have reduced the viscosity, thereby improving the mass transfer rates of CO{sub 2} absorption/desorption and decreasing the processing costs for pumping the solvent. In this project, we have made systematic changes to the structure of these compounds to improve several physical and thermodynamic properties important for CO{sub 2} capture. Through these structure-property paradigms, we have obtained a RevIL which requires only a third of the energy required by conventional aqueous MEA process for 90% CO{sub 2} capture.

  8. Reversible Ionic Liquids as Double-Action Solvents for Efficient CO2 Capture

    SciTech Connect (OSTI)

    Eckert, Charles; Liotta, Charles

    2011-09-30T23:59:59.000Z

    We have developed a novel class of CO{sub 2} capture solvents, Reversible Ionic Liquids (RevILs), that offer high absorption capacity through two modes of capture: chemical reaction (chemisorption) and physical solubility (physisorption). These solvents are silicon containing alkaline compounds such as silylamines that form a liquid salt (ionic liquid) upon reaction with CO{sub 2}. Subsequently, modest elevations in temperature reverse the reaction and yield pure CO{sub 2} for sequestration. By incorporating Si in the molecules we have reduced the viscosity, thereby improving the mass transfer rates of CO{sub 2} absorption/desorption and decreasing the processing costs for pumping the solvent. In this project, we have made systematic changes to the structure of these compounds to improve several physical and thermodynamic properties important for CO{sub 2} capture. Through these structure-property paradigms, we have obtained a RevIL which requires only a third of the energy required by conventional aqueous MEA process for 90% CO{sub 2} capture.

  9. Ionic Liquids: Breakthrough Absorption Technology for Post-Combustion CO{sub 2} Capture

    SciTech Connect (OSTI)

    Maginn, Edward

    2012-09-30T23:59:59.000Z

    This is the final report for DE-FC26-07NT43091 â??Ionic Liquids: Breakthrough Absorption Technology for Post-Combustion CO{sub 2} Captureâ?. A detailed summary is provided of the ionic liquid (IL) discovery process, synthesis and testing results, process / systems modeling, lab-scale operational testing, corrosion testing and commercialization possibilities. The work resulted in the discovery of a new class of ionic liquids (ILs) that efficiently react with CO{sub 2} in a 1:1 stoichiometry with no water present and no increase in viscosity. The enthalpy of reaction was tuned to optimize process economics. The IL was found to have excellent corrosion behavior with and without CO{sub 2} present. In lab-scale tests, the IL was able to effectively remove CO{sub 2} from a simulated flue gas stream, although mass transfer was slower than with aqueous monoethanolamine (MEA) due to higher viscosities. The non-volatile nature of the solvent and its high thermal stability, however, make it an intriguing option. An independent systems analysis indicates that the economics of using the best IL discovered to date (NDIL0157), are at least comparable to â?? and potentially slightly better than -â?? the Fluor Econamine FG PlusTM process (DOE Case 12). Further work should be directed at improving mass transfer / lowering viscosity and developing commercial synthesis routes to make these ILs at scale in an inexpensive manner. Demonstration of the process at larger scales is also warranted, as is the exploration of other process configurations that leverage the anhydrous nature of the solvent and its extremely low volatility.

  10. Bicyclic imidazolium ionic liquids as potential electrolytes for rechargeable lithium ion batteries

    SciTech Connect (OSTI)

    Liao, Chen [ORNL; Shao, Nan [ORNL; Bell, Jason R [ORNL; Guo, Bingkun [ORNL; Luo, Huimin [ORNL; Jiang, Deen [ORNL; Dai, Sheng [ORNL

    2013-01-01T23:59:59.000Z

    A bicyclic imidazolium ionic liquids, 1-ethyl-2,3-trimethyleneimidazolium bis(tri fluoromethane sulfonyl)imide ([ETMIm][TFSI]), and reference imidazolium compounds, 1-ethyl-3-methylimidazolium bis(trifluoromethane sulfonyl)imide ([EMIm][TFSI]) and 1, 2-dimethyl-3-butylimidazolium bis(trifluoromethane sulfonyl)imide ([DMBIm][TFSI]), were synthesized and investigated as solvents for lithium ion batteries. Although the alkylation at the C-2 position of the imidazolium ring does not affect the thermal stability of the ionic liquids, with or without the presence of 0.5 molar lithium bis(trifluoromethane sulfonyl)imide (LiTFSI), the stereochemical structure of the molecules has shown profound influences on the electrochemical properties of the corresponding ionic liquids. [ETMIm][TFSI] shows better reduction stability than do [EMIm][TFSI] and [DMBIm][TFSI], as confirmed by both linear sweep voltammery (LSV) and theoretical calculation. The Li||Li cell impedance of 0.5M LiTFSI/[ETMIm][TFSI] is stabilized, whereas that of 0.5M LiTFSI/[DMBIm][TFSI] is still fluctuating after 20 hours, indicating a relatively stable solid electrolyte interphase (SEI) is formed in the former. Furthermore, the Li||graphite half-cell based on 0.5M LiTFSI/[BTMIm][TFSI] exhibits reversible capacity of 250mAh g-1 and 70mAh g-1 at 25 C, which increases to 330 mAh g-1 and 250 mAh g-1 at 50 C, under the current rate of C/20 and C/10, respectively. For comparison, the Li||graphite half-cell based on 0.5M LiTFSI/[DMBIm][TFSI] exhibits poor capacity retention under the same current rate at both temperatures.

  11. THERMOPHYSICAL PROPERTIES OF NANOPARTICLE-ENHANCED IONIC LIQUIDS HEAT TRANSFER FLUIDS

    SciTech Connect (OSTI)

    Fox, E.

    2013-04-15T23:59:59.000Z

    An experimental investigation was completed on nanoparticle enhanced ionic liquid heat transfer fluids as an alternative to conventional organic based heat transfer fluids (HTFs). These nanoparticle-based HTFs have the potential to deliver higher thermal conductivity than the base fluid without a significant increase in viscosity at elevated temperatures. The effect of nanoparticle morphology and chemistry on thermophysical properties was examined. Whisker shaped nanomaterials were found to have the largest thermal conductivity temperature dependence and were also less likely to agglomerate in the base fluid than spherical shaped nanomaterials.

  12. Ionic liquid pretreatment of poplar wood at room temperature: swelling and incorporation of nanoparticles

    SciTech Connect (OSTI)

    Lucas, Marcel [Los Alamos National Laboratory; Macdonald, Brian A [Los Alamos National Laboratory; Wagner, Gregory L [Los Alamos National Laboratory; Joyce, Steven A [Los Alamos National Laboratory; Rector, Kirk D [Los Alamos National Laboratory

    2010-01-01T23:59:59.000Z

    Lignocellulosic biomass represents a potentially sustainable source of liquid fuels and commodity chemicals. It could satisfy the energy needs for transportation and electricity generation, while contributing substantially to carbon sequestration and limiting the accumulation of greenhouse gases in the atmosphere. Potential feedstocks are abundant and include crops, agricultural wastes, forest products, grasses, and algae. Among those feedstocks, wood is mainly constituted of three components: cellulose, hemicellulose, and lignin. The conversion process of lignocellulosic biomass typically consists of three steps: (1) pretreatment; (2) hydrolysis of cellulose and hemicellulose into fermentable sugars; and (3) fermentation of the sugars into liquid fuels (ethanol) and other commodity chemicals. The pretreatment step is necessary due to the complex structure of the plant cell wall and the chemical resistance of lignin. Most current pretreatments are energy-intensive and/or polluting. So it is imperative to develop new pretreatments that are economically viable and environmentally friendly. Recently, ionic liquids have attracted considerable interest, due to their ability to dissolve biopolymers, such as cellulose, lignin, native switchgrass, and others. Ionic liquids are also considered green solvents, since they have been successfully recycled at high yields for further use with limited efficiency loss. Also, a few microbial cellulases remain active at high ionic liquid concentration. However, all studies on the dissolution of wood in ionic liquids have been conducted so far at high temperatures, typically above 90 C. Development of alternative pretreatments at room temperature is desirable to eliminate the additional energy cost. In this study, thin sections of poplar wood were swollen at room temperature by a 3 h ionic liquid (1-ethyl-3-methylimidazolium acetate or EMIMAc) pretreatment. The pretreated sample was then exposed to an aqueous suspension of nanoparticles that resulted in the sample contraction and the deposition of nanoparticles onto the surface and embedded into the cell wall. To date, both silver and gold particles ranging in size from 40-100 nm have been incorporated into wood. Penetration of gold nanoparticles of 100 nm diameter in the cell walls was best confirmed by near-infrared confocal Raman microscopy, since the deposition of gold nanoparticles induces a significant enhancement of the Raman signal from the wood in their close proximity, an enhancement attributed to the surface-enhanced Raman effect (SERS). After rinsing with water, scanning electron microscopy (SEM) and Raman images of the same areas show that most nanoparticles remained on the pretreated sample. Raman images at different depths reveal that a significant number of nanoparticles were incorporated into the wood sample, at depths up to 4 {micro}m, or 40 times the diameter of the nanoparticles. Control experiments on an untreated wood sample resulted in the deposition of nanoparticles only at the surface and most nanoparticles were removed upon rinsing. This particle incorporation process enables the development of new pretreatments, since the nanoparticles have a high surface-to-volume ratio and could be chemically functionalized. Other potential applications for the incorporated nanoparticles include isotope tracing, catalysis, imaging agents, drug-delivery systems, energy-storage devices, and chemical sensors.

  13. A Preliminary Study of Oxidation of Lignin from Rubber Wood to Vanillin in Ionic Liquid Medium

    E-Print Network [OSTI]

    Shamsuri, A A

    2013-01-01T23:59:59.000Z

    In this study, lignin was oxidised to vanillin by means of oxygen in ionic liquid (1,3-dimethylimidazolium methylsulphate) medium. The parameters of the oxidation reaction that have been investigated were the following: concentration of oxygen (5, 10, 15 and 20 ft3 h-1), reaction time (2, 4, 6, 8 and 10 h) and reaction temperature (25, 40, 60, 80 and 100{\\deg}C). The Fourier transform infrared spectroscopy, high performance liquid chromatography and ultraviolet-visible analyses were used to characterise the product. The results revealed vanillin as the product obtained via the oxidation reaction. The optimum parameters of vanillin production were 20 ft3 h-1 of oxygen for 10 h at 100{\\deg}C. In conclusion, 1,3-dimethylimidazolium methylsulphate could be used as an oxidation reaction medium for the production of vanillin from rubber wood lignin.

  14. Bias-dependent molecular-level structure of electrical double layer in ionic liquid on graphite

    SciTech Connect (OSTI)

    Black, Jennifer M [ORNL] [ORNL; Walters, Deron [Asylum Research, Santa Barbara, CA] [Asylum Research, Santa Barbara, CA; Labuda, Aleksander [Asylum Research, Santa Barbara, CA] [Asylum Research, Santa Barbara, CA; Feng, Guang [ORNL] [ORNL; Hillesheim, Patrick C [ORNL] [ORNL; Dai, Sheng [ORNL] [ORNL; Cummings, Peter T [ORNL] [ORNL; Kalinin, Sergei V [ORNL] [ORNL; Proksch, Roger [Asylum Research, Santa Barbara, CA] [Asylum Research, Santa Barbara, CA; Balke, Nina [ORNL] [ORNL

    2013-01-01T23:59:59.000Z

    Bias-dependent structure of electrochemical double layers at liquid-solid interfaces underpin a multitude of phenomena in virtually all areas of scientific enquiry ranging from energy storage and conversion systems, biology, to geophysics and geochemistry. Here we report the bias-evolution of the electric double layer structure of an ionic liquid on highly ordered pyrolytic graphite as a model system for carbon-based electrodes for electrochemical supercapacitors measured by atomic force microscopy. Matching the observed structures to molecular dynamics simulations allows us to resolve steric effects due to cation and anion layers. We observe reconfiguration under applied bias and the orientational transitions in the Stern layer. The synergy between molecular dynamics simulation and experiment provides a comprehensive picture of structural phenomena and long- and short range interactions. This insight will improve understanding of the mechanism of charge storage in electrochemical capacitors on a molecular level which can be used to enhance their electrochemical performance.

  15. Conductivity of ionic liquid-derived polymers with internal gold nanoparticle conduits.

    SciTech Connect (OSTI)

    Lee, S.; Cummins, M. D.; Willing, G. A.; Firestone, M. A.; Materials Science Division; Univ. of Louisville

    2009-01-01T23:59:59.000Z

    The transport properties of self-supporting Au nanoparticle-ionic liquid-derived polymer composites were characterized. Topographic AFM images confirm the perforated lamellar composite architecture determined by small-angle X-ray scattering (SAXS) and further show that the in situ synthesized Au nanoparticles are localized within the hydrophilic (water) domains of the structure. At low Au nanoparticle content, the images reveal incomplete packing of spherical particles (i.e., voids) within these columns. The confinement and organization of the Au nanoparticles within the hydrophilic columns give rise to a large manifold of optical resonances in the near-IR region. The bulk composite conductivity, R{sub b}, was determined by ac electrochemical impedance spectroscopy (EIS) for samples prepared with increasing Au{sup 3+} content over a frequency range of 10 Hz to 1 MHz. A 100-fold increase was observed in the bulk conductivity at room temperature for composites prepared with the highest amount of Au{sup 3+} (1.58 {+-} 0.065 {micro}mol) versus the no Au composite, with the former reaching a value of 1.3 x 10{sup -4} S cm{sup -1} at 25 C. The temperature dependence of the conductivity recorded over this range was well-modeled by the Arrhenius equation. EIS studies on samples containing the highest Au nanoparticle content over a broader range of frequencies (2 x 10{sup -2} Hz to 5 x 10{sup 5} Hz) identified a low frequency component ascribed to electronic conduction. Electronic conduction due to aggregated Au nanoparticles was further confirmed by dc conductivity measurements. This work identifies a nanostructured composite that exhibits both ionic transport through the polymeric ionic liquid and electronic conduction from the organized encapsulated columns of Au nanoparticles.

  16. Heats of vaporization of room temperature ionic liquids by tunable vacuum ultraviolet photoionization

    SciTech Connect (OSTI)

    Chambreau, Steven D.; Vaghjiani, Ghanshyam L.; To, Albert; Koh, Christine; Strasser, Daniel; Kostko, Oleg; Leone, Stephen R.

    2009-11-25T23:59:59.000Z

    The heats of vaporization of the room temperature ionic liquids (RTILs) N-butyl-N-methylpyrrolidinium bistrifluorosulfonylimide, N-butyl-N-methylpyrrolidinium dicyanamide, and 1-butyl-3-methylimidazolium dicyanamide are determined using a heated effusive vapor source in conjunction with single photon ionization by a tunable vacuum ultraviolet synchrotron source. The relative gas phase ionic liquid vapor densities in the effusive beam are monitored by clearly distinguished dissociative photoionization processes via a time-of-flight mass spectrometer at a tunable vacuum ultraviolet beamline 9.0.2.3 (Chemical Dynamics Beamline) at the Advanced Light Source synchrotron facility. Resulting in relatively few assumptions, through the analysis of both parent cations and fragment cations, the heat of vaporization of N-butyl-N-methylpyrrolidinium bistrifluorosulfonylimide is determined to be Delta Hvap(298.15 K) = 195+-19 kJ mol-1. The observed heats of vaporization of 1-butyl-3-methylimidazolium dicyanamide (Delta Hvap(298.15 K) = 174+-12 kJ mol-1) and N-butyl-N-methylpyrrolidinium dicyanamide (Delta Hvap(298.15 K) = 171+-12 kJ mol-1) are consistent with reported experimental values using electron impact ionization. The tunable vacuum ultraviolet source has enabled accurate measurement of photoion appearance energies. These appearance energies are in good agreement with MP2 calculations for dissociative photoionization of the ion pair. These experimental heats of vaporization, photoion appearance energies, and ab initio calculations corroborate vaporization of these RTILs as intact cation-anion ion pairs.

  17. Electrochemical investigations of ionic liquids with vinylene carbonate for applications in rechargeable lithium ion batteries

    SciTech Connect (OSTI)

    Sun, Xiao-Guang [ORNL; Dai, Sheng [ORNL

    2010-01-01T23:59:59.000Z

    Ionic liquids based on methylpropylpyrrolidinium (MPPY) and methylpropylpiperidinium (MPPI) cations and bis(trifluoromethanesulfionyl)imide (TFSI) anion have been synthesized and characterized by thermal analysis, cyclic voltammetry, impedance spectroscopy as well as gavanostatic charge/discharge tests. 10 wt% of vinylene carbonate (VC) was added to the electrolytes of 0.5 M LiTFSI/MPPY.TFSI and 0.5 M LiTFSI/MPPI.TFSI, which were evaluated in Li || natural graphite (NG) half cells at 25 oC and 50 oC under different current densities. At 25 oC, due to their intrinsic high viscosities, the charge/discharge capacities under the current density of 80 A cm-2 were much lower than those under the current density of 40 A cm-2. At 50 oC, with reduced viscosities, the charge/discharge capacities under both current densities were almost indistinguishable, which were also close to the typical values obtained using conventional carbonate electrolytes. In addition, the discharge capacities of the half cells were very stable with cycling, due to the effective formation of solid electrolyte interphase (SEI) on the graphite electrode. On the contrary, the charge/discharge capacities of the Li || LiCoO2 cells using both ionic liquid electrolytes under the current density of 40 A cm-2 decreased continually with cycling, which were primarily due to the low oxidative stability of VC on the surface of LiCoO2.

  18. Unusual mechanism for the short-range electron transfer within gold-alkanethiol-ionic-liquid films of subnanometer thickness

    SciTech Connect (OSTI)

    Khoshtariya, Dimitri E. [Department of Physics and Institute for Biophysics and Bionanosciences, I. Javakhishvili Tbilisi State University, I. Chavchavadze Avenue 3, 0128 Tbilisi, Georgia (United States); Department of Chemistry and Pharmacy, University of Erlangen-Nuernberg, Egerlandstrasse 1, 91058 Erlangen (Germany); Institute of Molecular Biology and Biophysics and Institute of Inorganic Chemistry and Electrochemistry, Gotua 12, 0160 Tbilisi, Georgia (United States); Dolidze, Tina D. [Department of Chemistry and Pharmacy, University of Erlangen-Nuernberg, Egerlandstrasse 1, 91058 Erlangen (Germany); Institute of Molecular Biology and Biophysics and Institute of Inorganic Chemistry and Electrochemistry, Gotua 12, 0160 Tbilisi, Georgia (United States); Eldik, Rudi van [Department of Chemistry and Pharmacy, University of Erlangen-Nuernberg, Egerlandstrasse 1, 91058 Erlangen (Germany)

    2009-12-15T23:59:59.000Z

    Exploiting nanoscopically tunable composite gold-alkanethiol-ionic-liquid/ferrocene self-assembled systems with tunable electron transfer distance, we discovered in the case of thinner alkanethiol films a thermally activated electron transfer pattern totally controlled by the viscosity-related slow relaxation mode(s) of the ionic liquid acting as the reactant's fluctuating environment. This pattern manifested through the activation enthalpy and volume parameters that are identical to those for viscous flow was explained in terms of the extreme adiabatic mechanism with a vanishing Marcus barrier (via the exponential Franck-Condon-like term approaching unity).

  19. [Cu(I)(bpp)]BF4: the first extended coordination network prepared solvothermally in an ionic liquid solvent

    E-Print Network [OSTI]

    Li, Jing

    , the two-dimensional net- work [Cu(bpp)]BF4 [bpp = 1,3-bis(4-pyridyl)propane], pro- duced via and 1,3-bis(4-pyridyl)propane (bpp) ligand. [bmim][BF4], as a room temperature ionic liquid, is air

  20. Laser Transferable Polymer-Ionic Liquid Separator/Electrolytes for Solid-State Rechargeable Lithium-Ion Microbatteries

    E-Print Network [OSTI]

    Arnold, Craig B.

    Laser Transferable Polymer-Ionic Liquid Separator/Electrolytes for Solid-State Rechargeable Lithium-Ion characterized by ac-impedance spectroscopy and in lithium- ion microbatteries. Size and weight percent effects be laser transferred onto a substrate to form a solid separator/electrolyte layer for a lithium ion power

  1. The Force Field for Amino Acid Based Ionic Liquids: Polar Residues

    E-Print Network [OSTI]

    Fileti, Eudes Eterno

    2015-01-01T23:59:59.000Z

    Ionic liquids (ILs) constitute one of the most active fields of research nowadays. Many organic and inorganic molecules can be converted into ions via relatively simple procedures. These ions can be combined into ILs. Amino acid based ILs (AAILs) represent a specific interest due to solubilization of biological species, participation in enzymatic catalysis, and capturing toxic gases. We develop a new force field (FF) for the seven selected AAILs comprising 1-ethyl-3-methylimidazolium cation and amino acid anions with polar residues. The anions were obtained via deprotonation of carboxyl group. We account for peculiar interactions between the anion and the cation by fitting electrostatic potential for an ion pair, in contrast to isolated ions. The van der Waals interactions were transferred from the CHARMM36 FF with minor modifications, as suggested by hybrid density functional theory. Compatibility between our parameters and CHARMM36 parameters is preserved. The developed interaction model fosters computation...

  2. Liquid metal ion source and alloy for ion emission of multiple ionic species

    DOE Patents [OSTI]

    Clark, Jr., William M. (Thousand Oaks, CA); Utlaut, Mark W. (Saugus, CA); Wysocki, Joseph A. (Oxnard, CA); Storms, Edmund K. (Los Alamos, NM); Szklarz, Eugene G. (Los Alamos, NM); Behrens, Robert G. (Los Alamos, NM); Swanson, Lynwood W. (McMinnville, OR); Bell, Anthony E. (McMinnville, OR)

    1987-06-02T23:59:59.000Z

    A liquid metal ion source and alloy for the simultaneous ion evaporation of arsenic and boron, arsenic and phosphorus, or arsenic, boron and phosphorus. The ionic species to be evaporated are contained in palladium-arsenic-boron and palladium-arsenic-boron-phosphorus alloys. The ion source, including an emitter means such as a needle emitter and a source means such as U-shaped heater element, is preferably constructed of rhenium and tungsten, both of which are readily fabricated. The ion sources emit continuous beams of ions having sufficiently high currents of the desired species to be useful in ion implantation of semiconductor wafers for preparing integrated circuit devices. The sources are stable in operation, experience little corrosion during operation, and have long operating lifetimes.

  3. Improved dye-sensitized solar cells by composite ionic liquid electrolyte incorporating layered titanium phosphate

    SciTech Connect (OSTI)

    Cheng, Ping; Lan, Tian; Wang, Wanjun; Wu, Haixia; Yang, Haijun; Guo, Shouwu [National Key Laboratory of Nano/Micro Fabrication Technology, Key Laboratory for Thin Film and Microfabrication of the Ministry of Education, Research Institute of Micro/Nano Science and Technology, Shanghai Jiao Tong University, Shanghai 200240 (China); Deng, Changsheng; Dai, Xiaming [Institute of Nuclear and New Energy Technology, Tsinghua University, Beijing 100084 (China)

    2010-05-15T23:59:59.000Z

    We reported a composite electrolyte prepared by incorporating layered {alpha}-titanium phosphate ({alpha}-TiP) into a binary ionic liquid of 1-propyl-3-methylimidazolium iodide (PMII) and 1-ethyl-3-methylimidazolium tetrafluoroborate (EmimBF{sub 4}) (volume ratio, 13:7) electrolyte. The addition of {alpha}-TiP markedly improved the photovoltaic properties of dye-sensitized solar cells (DSSCs) compared to that without {alpha}-TiP. The enhancement was explained by improved diffusion of tri-iodide (I{sub 3}{sup -}) ions, suppressed electron recombination with I{sub 3}{sup -} in the electrolyte and increased lifetime of electrons in mesoscopic TiO{sub 2} film. (author)

  4. Lubricants or lubricant additives composed of ionic liquids containing ammonium cations

    DOE Patents [OSTI]

    Qu, Jun (Knoxville, TN) [Knoxville, TN; Truhan, Jr.,; John J. (Cookeville, TN) [Cookeville, TN; Dai, Sheng (Knoxville, TN) [Knoxville, TN; Luo, Huimin (Knoxville, TN) [Knoxville, TN; Blau, Peter J. (Knoxville, TN) [Knoxville, TN

    2010-07-13T23:59:59.000Z

    A lubricant or lubricant additive is an ionic liquid alkylammonium salt. The alkylammonium salt has the structure R.sub.xNH.sub.(4-x).sup.+,[F.sub.3C(CF.sub.2).sub.yS(O).sub.2].sub.2N.sup- .- where x is 1 to 3, R is independently C.sub.1 to C.sub.12 straight chain alkyl, branched chain alkyl, cycloalkyl, alkyl substituted cycloalkyl, cycloalkyl substituted alkyl, or, optionally, when x is greater than 1, two R groups comprise a cyclic structure including the nitrogen atom and 4 to 12 carbon atoms, and y is independently 0 to 11. The lubricant is effective for the lubrication of many surfaces including aluminum and ceramics surfaces.

  5. Ionic Liquid Conditioning ofPoly(vinylferrocene) for the Doping/Undoping of Glycylglycylglycine Tripeptide

    SciTech Connect (OSTI)

    Tang, Yijum [Oakland University, Rochester, MI; Baker, Gary A [ORNL; Zeng, Xiangqun [Oakland University, Rochester, MI

    2010-01-01T23:59:59.000Z

    Potentiodynamic electrochemical measurements of the redox-driven entry and exit of ionized glycylglycylglycine peptide (GGG-) during polymer oxidation and reduction, respectively, are presented and interpreted for electroactive poly(vinylferrocene) (PVF)-modified electrodes. Frequently, electrochemically controlled redox cycling results in the dramatic alteration in polymer film properties, typically accompanied by loss of redox activity, exemplified in this case by negligible currents associated with repeated exposure to GGG. Notably, we have discovered that preconditioning of PVF films with suitable ionic liquids (ILs) such as the N-alkyl-N-methylpyrrolidinium bis(trifluoromethanesulfonyl)imides allows the electroactive film to relax to a state compatible with reversible GGG- doping/undoping. Our studies substantiate that both the cation and the anion of the IL must be considered as both play important roles in appropriately conditioning the PVF polymer films. Indeed, ILs with structures and properties highly divergent from the target GGG- failed to properly condition PVF to a compatible state.

  6. Free Radical Polymerization of Styrene and Methyl Methacrylate in Various Room Temperature Ionic Liquids

    SciTech Connect (OSTI)

    Zhang, Hongwei [University of Tennessee, Knoxville (UTK); Hong, Kunlun [ORNL; Mays, Jimmy [ORNL

    2005-01-01T23:59:59.000Z

    Conventional free radical polymerization of styrene and methyl methacrylate was carried out in various room temperature ionic liquids (RTILs). The RTILs used in this research encompass a wide range of cations and anions. Typical cations include imidazolium, phosphonium, pyridinium, and pyrrolidinium; typical anions include amide, borate, chloride, imide, phosphate, and phosphinate. Reactions are faster and polymers obtained usually have higher molecular weights when compared to polymerizations carried out in volatile organic solvents under the same conditions. This shows that rapid rates of polymerization and high molecular weights are general features of conventional radical polymerizations in RTILs. Attempts to correlate the polarities and viscosities of the RTILs with the polymerization behavior fail to yield discernible trends.

  7. Impact of Mixed Feedstocks and Feedstock Densification on Ionic Liquid Pretreatment Efficiency

    SciTech Connect (OSTI)

    Jian Shi; Vicki S. Thompson; Neal A. Yancey; Vitalie Stavila; Blake A. Simmons; Seema Singh

    2013-01-01T23:59:59.000Z

    Background: Lignocellulosic biorefineries must be able to efficiently process the regional feedstocks that are available at cost-competitive prices year round. These feedstocks typically have low energy densities and vary significantly in composition. One potential solution to these issues is blending and/or densifying the feedstocks in order to create a uniform feedstock. Results/discussion: We have mixed four feedstocks - switchgrass, lodgepole pine, corn stover, and eucalyptus - in flour and pellet form and processed them using the ionic liquid 1-ethyl-3-methylimidazolium acetate. Sugar yields from both the mixed flour and pelletized feedstocks reach 90% within 24 hours of saccharification. Conclusions: Mixed feedstocks, in either flour or pellet form, are efficiently processed using this pretreatment process, and demonstrate that this approach has significant potential.

  8. Determining diffusion coefficients of ionic liquids by means of field cycling nuclear magnetic resonance relaxometry

    SciTech Connect (OSTI)

    Kruk, D. [Faculty of Mathematics and Computer Science, University of Warmia and Mazury in Olsztyn, S?oneczna 54, PL-10710 Olsztyn (Poland); Universität Bayreuth, Experimentalphysik II, 95440 Bayreuth (Germany); Meier, R.; Rössler, E. A. [Universität Bayreuth, Experimentalphysik II, 95440 Bayreuth (Germany); Rachocki, A. [Institute of Molecular Physics, Polish Academy of Sciences, Smoluchowskiego 17, 60-179 Pozna? (Poland); Korpa?a, A. [Department of Biophysics, Jagiellonian University Medical College, ?azarza 16, 31-530 Kraków, Poland and Institute of Physics, Jagiellonian University, Reymonta 4, 30-059 Kraków (Poland); Singh, R. K. [Ionic Liquid and Solid State Ionics Laboratory, Department of Physics, Banaras Hindu University, Varanasi 221 005 (India)

    2014-06-28T23:59:59.000Z

    Field Cycling Nuclear Magnetic Resonance (FC NMR) relaxation studies are reported for three ionic liquids: 1-ethyl-3- methylimidazolium thiocyanate (EMIM-SCN, 220–258 K), 1-butyl-3-methylimidazolium tetrafluoroborate (BMIM-BF{sub 4}, 243–318 K), and 1-butyl-3-methylimidazolium hexafluorophosphate (BMIM-PF{sub 6}, 258–323 K). The dispersion of {sup 1}H spin-lattice relaxation rate R{sub 1}(?) is measured in the frequency range of 10 kHz–20 MHz, and the studies are complemented by {sup 19}F spin-lattice relaxation measurements on BMIM-PF{sub 6} in the corresponding frequency range. From the {sup 1}H relaxation results self-diffusion coefficients for the cation in EMIM-SCN, BMIM-BF{sub 4}, and BMIM-PF{sub 6} are determined. This is done by performing an analysis considering all relevant intra- and intermolecular relaxation contributions to the {sup 1}H spin-lattice relaxation as well as by benefiting from the universal low-frequency dispersion law characteristic of Fickian diffusion which yields, at low frequencies, a linear dependence of R{sub 1} on square root of frequency. From the {sup 19}F relaxation both anion and cation diffusion coefficients are determined for BMIM-PF{sub 6}. The diffusion coefficients obtained from FC NMR relaxometry are in good agreement with results reported from pulsed- field-gradient NMR. This shows that NMR relaxometry can be considered as an alternative route of determining diffusion coefficients of both cations and anions in ionic liquids.

  9. Methods for applying microchannels to separate methane using liquid absorbents, especially ionic liquid absorbents from a mixture comprising methane and nitrogen

    DOE Patents [OSTI]

    Tonkovich, Anna Lee Y. (Dublin, OH); Litt, Robert D. (Westerville, OH); Dongming, Qiu (Dublin, OH); Silva, Laura J. (Plain City, OH); Lamont, Micheal Jay (Plain City, OH); Fanelli, Maddalena (Plain City, OH); Simmons, Wayne W. (Plain city, OH); Perry, Steven (Galloway, OH)

    2011-10-04T23:59:59.000Z

    Methods of using microchannel separation systems including absorbents to improve thermal efficiency and reduce parasitic power loss. Energy is typically added to desorb methane and then energy or heat is removed to absorb methane using a working solution. The working solution or absorbent may comprise an ionic liquid, or other fluids that demonstrate a difference in affinity between methane and nitrogen in a solution.

  10. Deprotonation and oligomerization in photo-, radiolytically and electrochemically induced redox reactions in hydrophobic alkylalkylimidazolium ionic liquids.

    SciTech Connect (OSTI)

    Shkrob, I . A.; Chemical Sciences and Engineering Division

    2010-01-14T23:59:59.000Z

    Radical chemistry initiated by one-electron reduction of 1-methyl-3-alkylimidazolium cations in the corresponding ionic liquids (ILs) is examined. The reaction scheme is examined in light of the recent experimental data on photo-, radiation-, and electrochemically induced degradation of the practically important hydrophobic alkylimidazolium ILs. It is suggested that the primary species leading to the formation of the oligomers and acidification of the IL is a {sigma}{sigma}* dimer radical cation that loses a proton, yielding a neutral radical whose subsequent reactions produce C(2)-C(2) linked oligomers, both neutral and charged. The neutral oligomers (up to the tetramer) account for the features observed in the NMR spectra of cathodic liquid generated in electrolytic breakdown of the IL solvent. In photolysis and radiolysis, these neutral species and/or their radical precursors are oxidized by radical (ions) derived from the counteranions, and only charged dimers are observed. The dication dimers account for the features observed in the mass spectra of irradiated ILs. The products of these ion radical and radical reactions closely resemble those generated via carbene chemistry, without the formation of the carbene via the deprotonation of the parent cation. As the loss of 2-protons increases the proticity of the irradiated IL, it interferes with the extraction of metal ions by ionophore solutes, while the formation of the oligomers modifies solvent properties. Thus, the peculiarities of radical chemistry in the alkylimidazolium ILs have significant import for their practical applications.

  11. Dynamics in Supercooled Ionic Organic Liquids and Mode Coupling Theory Analysis Jie Li, Irene Wang, Kendall Fruchey, and Michael D. Fayer*

    E-Print Network [OSTI]

    Fayer, Michael D.

    Dynamics in Supercooled Ionic Organic Liquids and Mode Coupling Theory Analysis Jie Li, Irene Wang effect experiments are applied to study the orientational dynamics of the supercooled ionic organic law decays followed by a final exponential decay. A mode coupling theory (MCT) schematic model

  12. Vehicle Technologies Office Merit Review 2014: Ionic Liquids as Anti-Wear Additives for Next-Generation Low-Viscosity Fuel-Efficient Engine Lubricants

    Broader source: Energy.gov [DOE]

    Presentation given by Oak Ridge National Laboratory at 2014 DOE Hydrogen and Fuel Cells Program and Vehicle Technologies Office Annual Merit Review and Peer Evaluation Meeting about ionic liquids...

  13. Bis(fluoromalonato)borate (BFMB) Anion Based Ionic Liquid As an Additive for Lithium-Ion Battery Electrolytes

    SciTech Connect (OSTI)

    Sun, Xiao-Guang [ORNL] [ORNL; Liao, Chen [ORNL] [ORNL; Baggetto, Loic [ORNL] [ORNL; Guo, Bingkun [ORNL] [ORNL; Unocic, Raymond R [ORNL] [ORNL; Veith, Gabriel M [ORNL] [ORNL; Dai, Sheng [ORNL] [ORNL

    2014-01-01T23:59:59.000Z

    Propylene carbonate (PC) is a good solvent for lithium ion battery applications due to its low melting point and high dielectric constant. However, PC is easily intercalated into graphite causing it to exfoliate, killing its electrochemical performance. Here we report on the synthesis of a new ionic liquid electrolyte based on partially fluorinated borate anion, 1-butyl-1,2-dimethylimidazolium bis(fluoromalonato)borate (BDMIm.BFMB), which can be used as an additive in 1 M LiPF6/PC electrolyte to suppress graphite exfoliation and improve cycling performance. In addition, both PC and BDMIm.BFMB can be used synergistically as additive to 1.0M LiPF6/methyl isopropyl sulfone (MIPS) to dramatically improve its cycling performance. It is also found that the chemistry nature of the ionic liquids has dramatic effect on their role as additive in PC based electrolyte.

  14. An XAFS Study of Nickel Chloride in the Ionic Liquid 1-ethyl-3-methyl Imidazolium Chloride/ Aluminum Chloride

    SciTech Connect (OSTI)

    Roeper, D.; Cheek, G; Pandya, K; O'Gragy, W

    2008-01-01T23:59:59.000Z

    The electrodeposition of metals from aqueous solutions has a successful history for many metals. However, some metals cannot be deposited from aqueous solutions because their potentials fall outside of the window of stability for water. Using ionic liquids for the electrodeposition of metals can avoid some of these difficulties because they have a larger region of stability than water. The electrochemical window can be tailored to fit a particular application by choosing appropriate anions and cations to form the melt. There is also the possibility to deposit pure metals without the oxides and hydrides that can form in aqueous solutions. The study of the structure of metal salts in ionic liquids is an important step towards achieving these goals.

  15. Lithium Ion Transport Mechanism in Ternary Polymer Electrolyte-Ionic Liquid Mixtures - A Molecular Dynamics Simulation Study

    E-Print Network [OSTI]

    Diddo Diddens; Andreas Heuer

    2013-02-20T23:59:59.000Z

    The lithium transport mechanism in ternary polymer electrolytes, consisting of PEO/LiTFSI and various fractions of the ionic liquid N-methyl-N-propylpyrrolidinium bis(trifluoromethane)sulfonimide, are investigated by means of MD simulations. This is motivated by recent experimental findings [Passerini et al., Electrochim. Acta 2012, 86, 330-338], which demonstrated that these materials display an enhanced lithium mobility relative to their binary counterpart PEO/LiTFSI. In order to grasp the underlying microscopic scenario giving rise to these observations, we employ an analytical, Rouse-based cation transport model [Maitra at al., PRL 2007, 98, 227802], which has originally been devised for conventional polymer electrolytes. This model describes the cation transport via three different mechanisms, each characterized by an individual time scale. It turns out that also in the ternary electrolytes essentially all lithium ions are coordinated by PEO chains, thus ruling out a transport mechanism enhanced by the presence of ionic-liquid molecules. Rather, the plasticizing effect of the ionic liquid contributes to the increased lithium mobility by enhancing the dynamics of the PEO chains and consequently also the motion of the attached ions. Additional focus is laid on the prediction of lithium diffusion coefficients from the simulation data for various chain lengths and the comparison with experimental data, thus demonstrating the broad applicability of our approach.

  16. Hormetic effect of ionic liquid 1-ethyl-3-methylimidazolium acetate on bacteria

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Nancharaiah, Y. V. [Bhabha Atomic Research Center, Kalpakkam (India). Biofouling and Biofilm Processes Sect.; Francis, A. J. [Brookhaven National Laboratory (BNL), Upton, NY (United States). Environmental Sciences Dept.; POSTECH, Pohang (Korea, Rep. of). Div. of Advanced Nuclear Engineering

    2015-06-01T23:59:59.000Z

    The biological effect of ionic liquids (ILs) is one of the highly debated topics as they are being contemplated for various industrial applications. 1-ethyl-2-methylimidazolium acetate ([EMIM][Ac]) showed remarkable hormesis on anaerobic Clostridium sp. and aerobic Psueudomonas putida. Bacterial growth was stimulated at up to 2.5 g L-1 and inhibited at > 2.5 g L-1 of ([EMIM][Ac]). The growth of Clostridium sp. and P. putida were higher by 0.4 and 4-fold respectively, in the presense of 0.5 g L-1 of ([EMIM][Ac]). Assessment of the effect of [EMIM][Ac] under different growth conditions showed that the hormesis of [EMIM][Ac] was mediated via regulation of medium pH. Hormetic effect of [EMIM][Ac] was evident only in medium with poor buffering capacity and in the presence of a fermentable substrate as the carbon source. The hormetic effect of [EMIM][Ac] on bacterial growth is most likely associated with the buffering capacity of acetate anion. These observations have implications in ILs toxicity studies and ecological risk assessment.

  17. Ionic Liquid-Enhanced Solid State Electrolyte Interface (SEI) for Lithium Sulfur Batteries

    SciTech Connect (OSTI)

    Zheng, Jianming; Gu, Meng; Chen, Honghao; Meduri, Praveen; Engelhard, Mark H.; Zhang, Jiguang; Liu, Jun; Xiao, Jie

    2013-05-16T23:59:59.000Z

    Li-S battery is a complicated system with many challenges existing before its final market penetration. While most of the reported work for Li-S batteries is focused on the cathode design, we demonstrate in this work that the anode consumption accelerated by corrosive polysulfide solution also critically determines the Li-S cell performance. To validate this hypothesis, ionic liquid (IL) N-methyl-N-butylpyrrolidinium bis(trifluoromethylsulfonyl)imide (Py14TFSI) has been employed to modify the properties of SEI layer formed on Li metal surface in Li-S batteries. It is found that the IL-enhanced passivation film on the lithium anode surface exhibits much different morphology and chemical compositions, effectively protecting lithium metal from continuous attack by soluble polysulfides. Therefore, both cell impedance and the irreversible consumption of polysulfides on lithium metal are reduced. As a result, the Coulombic efficiency and the cycling stability of Li-S batteries have been greatly improved. After 120 cycles, Li-S battery cycled in the electrolyte containing IL demonstrates a high capacity retention of 94.3% at 0.1 C rate. These results unveil another important failure mechanism for Li-S batteries and shin the light on the new approaches to improve Li-S battery performances.

  18. Hormetic effect of ionic liquid 1-ethyl-3-methylimidazolium acetate on bacteria

    DOE Public Access Gateway for Energy & Science Beta (PAGES Beta)

    Nancharaiah, Y. V.; Francis, A. J.

    2015-06-01T23:59:59.000Z

    The biological effect of ionic liquids (ILs) is one of the highly debated topics as they are being contemplated for various industrial applications. 1-ethyl-2-methylimidazolium acetate ([EMIM][Ac]) showed remarkable hormesis on anaerobic Clostridium sp. and aerobic Psueudomonas putida. Bacterial growth was stimulated at up to 2.5 g L-1 and inhibited at > 2.5 g L-1 of ([EMIM][Ac]). The growth of Clostridium sp. and P. putida were higher by 0.4 and 4-fold respectively, in the presense of 0.5 g L-1 of ([EMIM][Ac]). Assessment of the effect of [EMIM][Ac] under different growth conditions showed that the hormesis of [EMIM][Ac] was mediated via regulationmore »of medium pH. Hormetic effect of [EMIM][Ac] was evident only in medium with poor buffering capacity and in the presence of a fermentable substrate as the carbon source. The hormetic effect of [EMIM][Ac] on bacterial growth is most likely associated with the buffering capacity of acetate anion. These observations have implications in ILs toxicity studies and ecological risk assessment.« less

  19. Electrochemical Polishing Applications and EIS of a Vitamin B{sub 4}-Based Ionic Liquid

    SciTech Connect (OSTI)

    Wixtrom, Alex I. [Christopher Newport University, Newport News, VA (United States); Buhler, Jessica E. [Christopher Newport University, Newport News, VA (United States); Reece, Charles E. [Thomas Jefferson National Accelerator Facility, Newport News, VA (United States); Abdel-Fattah, Tarek M. [Christopher Newport University, Newport News, VA (United States)

    2013-01-01T23:59:59.000Z

    Modern particle accelerators require minimal interior surface roughness for Niobium superconducting radio frequency (SRF) cavities. Polishing of the Nb is currently achieved via electrochemical polishing with concentrated mixtures of sulfuric and hydrofluoric acids. This acid-based approach is effective at reducing the surface roughness to acceptable levels for SRF use, but due to acid-related hazards and extra costs (including safe disposal of used polishing solutions), an acid-free method would be preferable. This study focuses on an alternative electrochemical polishing method for Nb, using a novel ionic liquid solution containing choline chloride, also known as Vitamin B{sub 4} (VB{sub 4}). Potentiostatic electrochemical impedance spectroscopy (EIS) was also performed on the VB4-based system. Nb polished using the VB4-based method was found to have a final surface roughness comparable to that achieved via the acid-based method, as assessed by atomic force microscopy (AFM). These findings indicate that acid-free VB{sub 4}-based electrochemical polishing of Nb represents a promising replacement for acid-based methods of SRF cavity preparation.

  20. Lithium-sulfur batteries based on nitrogen-doped carbon and ionic liquid electrolyte

    SciTech Connect (OSTI)

    Sun, Xiao-Guang [ORNL; Wang, Xiqing [ORNL; Mayes, Richard T [ORNL; Dai, Sheng [ORNL

    2012-01-01T23:59:59.000Z

    Nitrogen-doped mesoporous carbon (NC) and sulfur were used to prepare an NC/S composite cathode, which was evaluated in an ionic liquid electrolyte of 0.5 M lithium bis(trifluoromethane sulfonyl)imide (LiTFSI) in methylpropylpyrrolidinium bis(trifluoromethane sulfonyl)imide (MPPY.TFSI) by cyclic voltammetry (CV), electrochemical impedance spectroscopy (EIS), and cycle testing. To facilitate the comparison, a C/S composite based on activated carbon (AC) without nitrogen doping was also fabricated under the same conditions as those for the NC/S composite. Compared with the AC/S composite, the NC/S composite showed enhanced activity toward sulfur reduction, as evidenced by the early onset sulfur reduction potential, higher redox current density in the CV test, and faster charge transfer kinetics as indicated by EIS measurement. At room temperature under a current density of 84 mA g-1 (C/20), the battery based on the NC/S composite exhibited higher discharge potential and an initial capacity of 1420 mAh g-1 whereas that based on the AC/S composite showed lower discharge potential and an initial capacity of 1120 mAh g-1. Both batteries showed similar capacity fading with cycling due to the intrinsic polysulfide solubility and the polysulfide shuttle mechanism; the capacity fading can be improved by further modification of the cathode.

  1. Ionic Liquid and Supercritical Fluid Hyphenated Techniques for Dissolution and Separation of Lanthanides, Actinides, and Fission Products

    SciTech Connect (OSTI)

    Wai, Chien M. [Univ. of Idaho, Moscow, ID (United States); Bruce Mincher

    2012-12-01T23:59:59.000Z

    This project is investigating techniques involving ionic liquids (IL) and supercritical (SC) fluids for dissolution and separation of lanthanides, actinides, and fission products. The research project consists of the following tasks: Study direct dissolution of lanthanide oxides, uranium dioxide and other actinide oxides in [bmin][Tf{sub 2}N] with TBP(HNO{sub 3}){sub 1.8}(H{sub 2}O){sub 0.6} and similar types of Lewis acid-Lewis base complexing agents; Measure distributions of dissolved metal species between the IL and the sc-CO{sub 2} phases under various temperature and pressure conditions; Investigate the chemistry of the dissolved metal species in both IL and sc-CO{sub 2} phases using spectroscopic and chemical methods; Evaluate potential applications of the new extraction techniques for nuclear waste management and for other projects. Supercritical carbon dioxide (sc-CO{sub 2}) and ionic liquids are considered green solvents for chemical reactions and separations. Above the critical point, CO{sub 2} has both gas- and liquid-like properties, making it capable of penetrating small pores of solids and dissolving organic compounds in the solid matrix. One application of sc-CO{sub 2} extraction technology is nuclear waste management. Ionic liquids are low-melting salts composed of an organic cation and an anion of various forms, with unique properties making them attractive replacements for the volatile organic solvents traditionally used in liquid-liquid extraction processes. One type of room temperature ionic liquid (RTIL) based on the 1-alkyl-3-methylimidazolium cation [bmin] with bis(trifluoromethylsulfonyl)imide anion [Tf{sub 2}N] is of particular interest for extraction of metal ions due to its water stability, relative low viscosity, high conductivity, and good electrochemical and thermal stability. Recent studies indicate that a coupled IL sc-CO{sub 2} extraction system can effectively transfer trivalent lanthanide and uranyl ions from nitric acid solutions. Advantages of this technique include operation at ambient temperature and pressure, selective extraction due to tunable sc-CO{sub 2} solvation strength, no IL loss during back-extraction, and no organic solvent introduced into the IL phase.

  2. THE POTENTIAL OF NANOPARTICLE ENHANCED IONIC LIQUIDS (NEILS) AS ADVANCED HEAT TRANSFER FLUIDS

    SciTech Connect (OSTI)

    Fox, E.; Bridges, N.; Visser, A.

    2011-09-14T23:59:59.000Z

    Interest in capturing the energy of the sun is rising as demands for renewable energy sources increase. One area of developing research is the use of concentrating solar power (CSP), where the solar energy is concentrated by using mirrors to direct the sunlight towards a collector filled with a heat transfer fluid (HTF). The HTF transfers the collected energy into pressurized steam, which is used to generate energy. The greater the energy collected by the HTF, the more efficent the electrical energy production is, thus the overall efficiency is controlled by the thermal fluid. Commercial HTFs such as Therminol{reg_sign} (VP-1), which is a blend of biphenyl and diphenyl oxide, have a significant vapor pressure, especially at elevated temperatures. In order for these volatile compounds to be used in CSP systems, the system either has to be engineered to prevent the phase change (i.e., volatilization and condensation) through pressurization of the system, or operate across the phase change. Over thirty years ago, a class of low-melting organic compounds were developed with negligible vapor pressure. These compounds are referred to as ionic liquids (ILs), which are organic-based compounds with discrete charges that cause a significant decrease in their vapor pressure. As a class, ILs are molten salts with a melting point below 100 C and can have a liquidus range approaching 400 C, and in several cases freezing points being below 0 C. Due to the lack of an appreciable vapor pressure, volatilization of an IL is not possible at atmospheric pressure, which would lead to a simplification of the design if used as a thermal fluid and for energy storage materials. Though the lack of a vapor pressure does not make the use of ILs a better HTF, the lack of a vapor pressure is a compliment to their higher heat capacity, higher volummetric density, and thus higher volumetric heat capacity. These favorable physical properties give ILs a pontential advantage over the current commerically used thermal fluids. Also within the past decade nanofluids have gained attention for thermal conductivity enhancment of fluids, but little analysis has been completed on the heat capacity effects of the nanoparticle addition. The idea of ILs or nanofluids as a HTF is not new, as there are several references that have proposed the idea. However, the use of ionic liquid nanofluids containing nanomaterials other than carbon nanotubes has never before been studied. Here, for the first time, nano-particle enhanced ILs (NEILs) have been shown to increase the heat capacity of the IL with no adverse side effects to the ILs thermal stability and, only at high nanoparticle loading, are the IL physical properties affected. An increase of volumetric heat capacity translates into a better heat transfer fluid as more energy is stored per volumetric unit in the solar concentrating section, thus more efficency in increased steam pressure. Results show that the properties of the NEIL are highly dependant on the suspended nanomaterial and careful materials selection is required to fully optimize the nanofluid properties.

  3. Identification of a haloalkaliphilic and thermostable cellulase with improved ionic liquid tolerance

    SciTech Connect (OSTI)

    Zhang, Tao; Datta, Supratim; Eichler, Jerry; Ivanova, Natalia; Axen, Seth D.; Kerfeld, Cheryl A.; Chen, Feng; Kyrpides, Nikos; Hugenholtz, Philip; Cheng, Jan-Fang; Sale, Kenneth L.; Simmons, Blake; Rubin, Eddy

    2011-02-17T23:59:59.000Z

    Some ionic liquids (ILs) have been shown to be very effective solvents for biomass pretreatment. It is known that some ILs can have a strong inhibitory effect on fungal cellulases, making the digestion of cellulose inefficient in the presence of ILs. The identification of IL-tolerant enzymes that could be produced as a cellulase cocktail would reduce the costs and water use requirements of the IL pretreatment process. Due to their adaptation to high salinity environments, halophilic enzymes are hypothesized to be good candidates for screening and identifying IL-resistant cellulases. Using a genome-based approach, we have identified and characterized a halophilic cellulase (Hu-CBH1) from the halophilic archaeon, Halorhabdus utahensis. Hu-CBH1 is present in a gene cluster containing multiple putative cellulolytic enzymes. Sequence and theoretical structure analysis indicate that Hu-CBH1 is highly enriched with negatively charged acidic amino acids on the surface, which may form a solvation shell that may stabilize the enzyme, through interaction with salt ions and/or water molecules. Hu-CBH1 is a heat tolerant haloalkaliphilic cellulase and is active in salt concentrations up to 5 M NaCl. In high salt buffer, Hu-CBH1 can tolerate alkali (pH 11.5) conditions and, more importantly, is tolerant to high levels (20percent w/w) of ILs, including 1-allyl-3-methylimidazolium chloride ([Amim]Cl). Interestingly, the tolerances to heat, alkali and ILs are found to be salt-dependent, suggesting that the enzyme is stabilized by the presence of salt. Our results indicate that halophilic enzymes are good candidates for the screening of IL-tolerant cellulolytic enzymes.

  4. The importance of ion size and electrode curvature on electrical double layers in ionic liquids

    SciTech Connect (OSTI)

    Feng, G.; Qiao, R.; Huang, J; Dai, S.; Sumpter, B. G.; Meunier, V.

    2011-01-01T23:59:59.000Z

    Room-temperature ionic liquids (ILs) are an emerging class of electrolytes for supercapacitors. We investigate the effects of ion size and electrode curvature on the electrical double layers (EDLs) in two ILs 1-butyl-3-methylimidazolium chloride [BMIM][Cl] and 1-butyl-3-methylimidazolium hexafluorophosphate [BMIM][PF{sub 6}], using a combination of molecular dynamics (MD) and quantum density functional theory (DFT) simulations. The sizes of the counter-ion and co-ion affect the ion distribution and orientational structure of EDLs. The EDL capacitances near both planar and cylindrical electrodes were found to follow the order: [BMIM][Cl] (near the positive electrode) > [BMIM][PF{sub 6}] (near the positive electrode) ? [BMIM][Cl] (near the negative electrode) ? [BMIM][PF{sub 6}] (near the negative electrode). The EDL capacitance was also found to increase as the electrode curvature increases. These capacitance data can be fit to the Helmholtz model and the recently proposed exohedral electrical double-cylinder capacitor (xEDCC) model when the EDL thickness is properly parameterized, even though key features of the EDLs in ILs are not accounted for in these models. To remedy the shortcomings of existing models, we propose a “Multiple Ion Layers with Overscreening” (MILO) model for the EDLs in ILs that takes into account two critical features of such EDLs, i.e., alternating layering of counter-ions and co-ions and charge overscreening. The capacitance computed from the MILO model agrees well with the MD prediction. Although some input parameters of the MILO model must be obtained from MD simulations, the MILO model may provide a new framework for understanding many important aspects of EDLs in ILs (e.g., the variation of EDL capacitance with the electrode potential) that are difficult to interpret using classical EDL models and experiments.

  5. The Importance of Ion Size and Electrode Curvature on Electrical Double Layers in Ionic Liquids

    SciTech Connect (OSTI)

    Feng, Guang [Clemson University; Qiao, Rui [ORNL; Huang, Jingsong [ORNL; Dai, Sheng [ORNL; Sumpter, Bobby G [ORNL; Meunier, Vincent [ORNL

    2010-01-01T23:59:59.000Z

    Room-temperature ionic liquids (ILs) are an emerging class of electrolytes for supercapacitors. We investigate the effects of ion size and electrode curvature on the electrical double layers (EDLs) in two ILs 1-butyl-3-methylimidazolium chloride [BMIM][Cl] and 1-butyl-3-methylimidazolium hexafluorophosphate [BMIM][PF(6)], using a combination of molecular dynamics (MD) and quantum density functional theory (DFT) simulations. The sizes of the counter-ion and co-ion affect the ion distribution and orientational structure of EDLs. The EDL capacitances near both planar and cylindrical electrodes were found to follow the order: [BMIM][Cl] (near the positive electrode) > [BMIM][PF(6)] (near the positive electrode) {approx} [BMIM][Cl] (near the negative electrode) {approx} [BMIM][PF(6)] (near the negative electrode). The EDL capacitance was also found to increase as the electrode curvature increases. These capacitance data can be fit to the Helmholtz model and the recently proposed exohedral electrical double-cylinder capacitor (xEDCC) model when the EDL thickness is properly parameterized, even though key features of the EDLs in ILs are not accounted for in these models. To remedy the shortcomings of existing models, we propose a 'Multiple Ion Layers with Overscreening' (MILO) model for the EDLs in ILs that takes into account two critical features of such EDLs, i.e., alternating layering of counter-ions and co-ions and charge overscreening. The capacitance computed from the MILO model agrees well with the MD prediction. Although some input parameters of the MILO model must be obtained from MD simulations, the MILO model may provide a new framework for understanding many important aspects of EDLs in ILs (e.g., the variation of EDL capacitance with the electrode potential) that are difficult to interpret using classical EDL models and experiments.

  6. Generation of gas-phase zirconium fluoroanions by electrospray of an ionic liquid

    SciTech Connect (OSTI)

    Gary S. Groenewold; James E. Delmore; Michael T. Benson; Tetsuya Tsuda; Rika Hagiwara

    2014-06-01T23:59:59.000Z

    RATIONALE: When measuring extremely wide isotope ratios (= 1 x 109) accelerator mass spectrometry (AMS) is the instrument of choice, however it requires an anion for injection into the tandem accelerator. Since many elements do not have positive electronegativities they do not form stable negative atomic ions, and hence are not compatible for isotope ratio measurement using AMS. Thus new approaches for forming anions are sought; fluoroanions are particularly attractive because fluorine is monoisotopic, and thus will not have overlapping isobars with the isotope of interest. METHODS: An approach is described for making zirconium fluoroanions using the fluorinating ionic liquid (IL) 1-ethyl-3-methylimidazolium fluorohydrogenate, which was used to generate abundant [ZrF5-] using electrospray ionization. The IL was dissolved in acetonitrile, combined with a dilute solution of either Zr4+ or ZrO2+, and then electrosprayed. Mass analysis and collision induced dissociation were conducted using a time-of-flight mass spectrometer. Cluster structures were predicted using density functional theory calculations. RESULTS: The fluorohydrogenate IL solutions generated abundant [ZrF5-] starting from solutions of both Zr4+ and ZrO2+. The mass spectra also contained IL-bearing cluster ions, whose compositions indicated the presence of [ZrF6]2- in solution, a conclusion supported by the structural calculations. Rinsing out the zirconium-IL solution with acetonitrile decreased the IL clusters, but enhanced [ZrF5]-, which was sorbed by the polymeric electrospray supply capillary, and then released upon rinsing. This reduced the ion background in the mass spectrum. CONCLUSIONS: The fluorohydrogenate-IL solutions are a facile way to form zirconium fluoroanions in the gas phase using electrospray. The approach has potential as a source of fluoroanions for injection into an AMS, which would enable high-sensitivity measurement of minor zirconium isotopes, and benefits from the absence of overlapping isobars caused by the charge carrier (i.e., the monoisotopic fluorine atoms).

  7. EXPERIMENTAL INVESTIGATION OF NATURAL CONVECTION HEAT TRANSFER OF IONIC LIQUID IN A RECTANGULAR ENCLOSURE HEATED FROM BELOW

    SciTech Connect (OSTI)

    Fox, E.; Visser, A.; Bridges, N.

    2011-07-18T23:59:59.000Z

    This paper presents an experimental study of natural convection heat transfer for an Ionic Liquid. The experiments were performed for 1-butyl-2, 3-dimethylimidazolium bis(trifluoromethylsulfonyl)imide, ([C{sub 4}mmim][NTf{sub 2}]) at a Raleigh number range of 1.26 x 10{sup 7} to 8.3 x 10{sup 7}. In addition to determining the convective heat transfer coefficients, this study also included experimental determination of thermophysical properties of [C{sub 4}mmim][NTf{sub 2}] such as, density, viscosity, heat capacity, and thermal conductivity. The results show that the density of [C{sub 4}mmim][NTf{sub 2}] varies from 1.437-1.396 g/cm{sup 3} within the temperature range of 10-50 C, the thermal conductivity varies from 0.105-0.116 W/m.K between a temperature of 10 to 60 C, the heat capacity varies from 1.015 J/g.K - 1.760 J/g.K within temperature range of 25-340 C and the viscosity varies from 18cp-243cp within temperature range 10-75 C. The results for density, thermal conductivity, heat capacity, and viscosity were in close agreement with the values in the literature. Measured dimensionless Nusselt number was observed to be higher for the ionic liquid than that of DI water. This is expected as Nusselt number is the ratio of heat transfer by convection to conduction and the ionic liquid has lower thermal conductivity (approximately 18%) than DI water.

  8. Conductance modulation in topological insulator Bi{sub 2}Se{sub 3} thin films with ionic liquid gating

    SciTech Connect (OSTI)

    Son, Jaesung; Banerjee, Karan; Yang, Hyunsoo, E-mail: eleyang@nus.edu.sg [Department of Electrical and Computer Engineering, National University of Singapore, 4 Engineering Drive 3, Singapore 117576 (Singapore)] [Department of Electrical and Computer Engineering, National University of Singapore, 4 Engineering Drive 3, Singapore 117576 (Singapore); Brahlek, Matthew; Koirala, Nikesh; Oh, Seongshik [Department of Physics and Astronomy, Rutgers, The State University of New Jersey, 136 Frelinghuysen Road, Piscataway, New Jersey 08854 (United States)] [Department of Physics and Astronomy, Rutgers, The State University of New Jersey, 136 Frelinghuysen Road, Piscataway, New Jersey 08854 (United States); Lee, Seoung-Ki [School of Advanced Materials Science and Engineering, Sungkyunkwan University, Suwon 440-746 (Korea, Republic of) [School of Advanced Materials Science and Engineering, Sungkyunkwan University, Suwon 440-746 (Korea, Republic of); School of Electrical and Electronic Engineering, Yonsei University, Seoul 120-749 (Korea, Republic of); Ahn, Jong-Hyun [School of Electrical and Electronic Engineering, Yonsei University, Seoul 120-749 (Korea, Republic of)] [School of Electrical and Electronic Engineering, Yonsei University, Seoul 120-749 (Korea, Republic of)

    2013-11-18T23:59:59.000Z

    A Bi{sub 2}Se{sub 3} topological insulator field effect transistor is investigated by using ionic liquid as an electric double layer gating material, leading to a conductance modulation of 365% at room temperature. We discuss the role of charged impurities on the transport properties. The conductance modulation with gate bias is due to a change in the carrier concentration, whereas the temperature dependent conductance change is originated from a change in mobility. Large conductance modulation at room temperature along with the transparent optical properties makes topological insulators as an interesting (opto)electronic material.

  9. Dynamics of electrical double layer formation in room-temperature ionic liquids under constant-current charging conditions

    SciTech Connect (OSTI)

    Jiang, Xikai [ORNL] [ORNL; Huang, Jingsong [ORNL] [ORNL; Zhao, Hui [University of Nevada, Las Vegas] [University of Nevada, Las Vegas; Sumpter, Bobby G [ORNL] [ORNL; Qiao, Rui [Clemson University] [Clemson University

    2014-01-01T23:59:59.000Z

    We report detailed simulation results on the formation dynamics of an electrical double layer (EDL) inside an electrochemical cell featuring room-temperature ionic liquids (RTILs) enclosed between two planar electrodes. Under relatively small charging currents, the evolution of cell potential during charging can be suitably predicted by the Landau-Ginzburg-type continuum model proposed recently (M. Z. Bazant, B. D. Storey, and A. A. Kornyshev, Phys. Rev. Lett., 106, 046102, 2011). Under very large charging currents, the cell potential shows pronounced oscillation during the initial stage of charging, a feature not captured by the continuum model. Such oscillation originates from the sequential growth of the ionic space charge layers near the electrode surface, allowing the evolution of EDLs in RTILs with time, an atomistic process difficult to visualize experimentally, to be studied by analyzing the cell potential under constant current charging conditions. While the continuum model cannot predict the potential oscillation under such far-from-equilibrium charging conditions, it can nevertheless qualitatively capture the growth of cell potential during the later stage of charging. Improving the continuum model by introducing frequency-dependent dielectric constant and density-dependent ion diffusion coefficients may help to further extend the applicability of the model. Keywords: ionic

  10. Inexpensive, Nonfluorinated Anions for Lithium Salts and Ionic...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Anions for Lithium Salts and Ionic Liquids for Lithium Battery Electrolytes Inexpensive, Nonfluorinated Anions for Lithium Salts and Ionic Liquids for Lithium Battery Electrolytes...

  11. Preparation of silica aerogel using ionic liquids as solvents Sheng Dai,*a Y. H. Ju,ac H. J. Gao,b J. S. Lin,b S. J. Pennycookb and C. E. Barnesc

    E-Print Network [OSTI]

    Gao, Hongjun

    Preparation of silica aerogel using ionic liquids as solvents Sheng Dai,*a Y. H. Ju,ac H. J. Gaord December 1999 Ionic liquids have been used as effective solvents to synthesize aerogels; a long aging time can be used to produce stable aerogel structures without the need for supercritical drying

  12. Curvature Effect on the Capacitance of Electric Double Layers at Ionic Liquid/Onion-Like Carbon Interfaces

    SciTech Connect (OSTI)

    Feng, Guang [ORNL; Jiang, Deen [ORNL; Cummings, Peter T [ORNL

    2012-01-01T23:59:59.000Z

    Recent experiments have revealed that onion-like carbons (OLCs) offer high energy density and charging/discharging rates when used as the electrodes in supercapacitors. To understand the physical origin of this phenomenon, molecular dynamics simulations were performed for a room-temperature ionic liquid near idealized spherical OLCs with radii ranging from 0.356 to 1.223 nm. We find that the surface charge density increases almost linearly with the potential applied on electric double layers (EDLs) near OLCs. This leads to a nearly flat shape of the differential capacitance versus the potential, unlike the bell or camel shape observed on planar electrodes. Moreover, our simulations reveal that the capacitance of EDLs on OLCs increases with the curvature or as the OLC size decreases, in agreement with experimental observations. The curvature effect is explained by dominance of charge overscreening over a wide potential range and increased ion density per unit area of electrode surface as the OLC becomes smaller.

  13. Use of Ionic Liquids as Physical Solvents for Selective Capture of CO2 from Fuel Gas Streams

    SciTech Connect (OSTI)

    Heintz, Y.J.; Sehabiague, L.; Morsi, B.I.; Jones, K.L.; Pennline, H.W.

    2008-07-01T23:59:59.000Z

    This study is to investigate the potential use of ionic liquids (ILs) as physical solvents for selective CO2 capture from post water-gas-shift reactor streams at elevated pressures and temperatures. The equilibrium gas solubility (x*) and the volumetric mass transfer coefficients (kLa) for CO2 and H2 in two different ILs (TEGO IL K5 and TEGO IL P51P) were determined. The data were obtained in an agitated reactor, equipped with sight-windows, in wide ranges of pressures, temperatures, mixing speeds, and liquid heights. Under the operating conditions investigated, the CO2 solubilities in the two ILs increased with pressure at constant temperature and decreased with temperature at constant pressure. Also, the volumetric liquid-side mass transfer coefficients of CO2 increased with mixing speed, pressure, and temperature and decreased with liquid height. The CO2 solubilities in the TEGO IL K5 were greater than those in the other two ILs at 500 K. Under similar operating conditions, the CO2 solubilities in the two ILs were greater than those of H2, which reflects the selective nature of ILs for CO2 capture. In addition, the ILs appeared to have negligible vapor pressure up to 500 K, which presents an advantage over conventional physical solvents currently employed for CO2 capture from post water-gas-shift reactor streams. This study demonstrated the thermal stability of the ILs and highlighted their ability to selectively capture CO2 at temperatures up to 500 K and pressures as high as 30 bars.

  14. High-Surface-Area CO2 Sponge: High Performance CO2 Scrubbing Based on Hollow Fiber-Supported Designer Ionic Liquid Sponges

    SciTech Connect (OSTI)

    None

    2010-09-01T23:59:59.000Z

    IMPACCT Project: The team from ORNL and Georgia Tech is developing a new technology that will act like a sponge, integrating a new, alcohol-based ionic liquid into hollow fibers (magnified image, right) to capture CO2 from the exhaust produced by coal-fired power plants. Ionic liquids, or salts that exist in liquid form, are promising materials for carbon capture and storage, but their tendency to thicken when combined with CO2 limits their efficiency and poses a challenge for their development as a cost-effective alternative to current-generation solutions. Adding alcohol to the mix limits this tendency to thicken in the presence of CO2 but can also make the liquid more likely to evaporate, which would add significantly to the cost of CO2 capture. To solve this problem, ORNL is developing new classes of ionic liquids with high capacity for absorbing CO2. ORNL’s sponge would reduce the cost associated with the energy that would need to be diverted from power plants to capture CO2 and release it for storage.

  15. Experimental investigation of the permeability and selectivity of supported ionic liquid membranes for CO2/He separation at temperatures up to 125° C

    SciTech Connect (OSTI)

    Ilconich, J.B.; Myers, C.R.; Pennline, H.W.; Luebke, D.R.

    2007-07-01T23:59:59.000Z

    Supported liquid membranes have been prepared by impregnation of commercial porous polymer films with the ionic liquid 1-n-hexyl-3- methylimidazolium bis(trifluoromethanesulfonyl)imide. The ionic liquid has been characterized, and the membranes have been tested to determine performance in the selective separation of CO2 from He. Experiments were conducted in a constant pressure system, and pure gas permeability/selectivity data are reported. Membranes prepared with polysulfone supports have been found to be stable to 125 °C. The CO2 permeability of the membranes increases from 744 to 1200 barrer as the temperature increases from 37 to 125 °C. The CO2/He selectivity decreased from 8.7 to 3.1 over the same temperature range.

  16. Hydrogen sulfide and carbon dioxide removal from dry fuel gas streams using an ionic liquid as a physical solvent

    SciTech Connect (OSTI)

    Yannick J. Heintz; Laurent Sehabiague; Badie I. Morsi; Kenneth L. Jones; David R. Luebke; Henry W. Pennline [United States Department of Energy (U.S. DOE), Pittsburgh, PA (United States). National Energy Technology Laboratory

    2009-09-15T23:59:59.000Z

    The mole fraction solubilities (x{asterisk}) and volumetric liquid-side mass-transfer coefficients (kLa) for H{sub 2}S and CO{sub 2} in the ionic liquid, TEGO IL K5, (a quaternary ammonium polyether) were measured under different pressures (up to 30 bar) and temperatures (up to 500 K) in a 4 L ZipperClave agitated reactor. CO{sub 2} and N{sub 2}, as single gases, and a H{sub 2}S/N{sub 2} gaseous mixture were used in the experiments. The solubilities of H{sub 2}S and CO{sub 2} were found to increase with pressure and decrease with temperature within the experimental conditions used. The H{sub 2}S solubilities in the ionic liquid (IL) were greater than those of CO{sub 2} within the temperature range investigated (300-500 K) up to a H{sub 2}S partial pressure of 2.33 bar. Hence, the IL can be effectively used to capture both H{sub 2}S and CO{sub 2} from dry fuel gas stream within the temperature range from 300 to 500 K under a total pressure up to 30 bar. The presence of H{sub 2}S in the H{sub 2}S/N{sub 2} mixture created mass-transfer resistance, which decreased k{sub L}{alpha} values for N{sub 2}. The k{sub L}{alpha} and x{asterisk} values of CO{sub 2} were found to be greater than those of N{sub 2} in the IL, which highlight the stronger selectivity of this physical solvent toward CO{sub 2} than toward N{sub 2}. In addition, within the temperature range from 300 to 500 K, the solubility and k{sub L}{alpha} of H{sub 2}S in the IL were greater than those of CO{sub 2}, suggesting that not only can H{sub 2}S be more easily captured from dry fuel gas streams but also a shorter absorber can be employed for H{sub 2}S capture than that for CO{sub 2}. 56 refs., 8 figs., 4 tabs.

  17. AGING EFFECTS ON THE PROPERTIES OF IMIDAZOLIUM, QUATERNARY AMMONIUM, PYRIDINIUM AND PYRROLIDINIUM-BASED IONIC LIQUIDS USED IN FUEL AND ENERGY PRODUCTION

    SciTech Connect (OSTI)

    Fox, E.

    2013-08-13T23:59:59.000Z

    Ionic liquids are often cited for their excellent thermal stability, a key property for their use as solvents and in the chemical processing of biofuels. However, there has been little supporting data on the long term aging effect of temperature on these materials. Imizadolium, quaternary ammonium, pyridinium, and pyrrolidnium-based ionic liquids with the bis(trifluoromethylsulfonyl)imide and bis(perfluoroethylsulfonyl)imide anions were aged for 2520 hours (15 weeks) at 200?C in air to determine the effects of an oxidizing environment on their chemical structure and thermal stability over time. It was found that the minor changes in the cation chemistry could greatly affect the properties of the ILs over time.

  18. Fluorohydrogenate Cluster Ions in the Gas Phase: Electrospray Ionization Mass Spectrometry of the [1-Ethyl-3-methylimidazolium+][F(HF)2.3–] Ionic Liquid

    SciTech Connect (OSTI)

    Gary S. Groenewold; James E. Delmore; Michael T. Benson; Tetsuya Tsuda; Rika Hagiwara

    2013-12-01T23:59:59.000Z

    Electrospray ionization of the fluorohydrogenate ionic liquid [1-ethyl-3-methylimidazolium][F(HF)2.3] ionic liquid was conducted to understand the nature of the anionic species as they exist in the gas phase. Abundant fluorohydrogenate clusters were produced; however, the dominant anion in the clusters was [FHF-], and not the fluoride-bound HF dimers or trimers that are seen in solution. Density functional theory (DFT) calculations suggest that HF molecules are bound to the clusters by about 30 kcal/mol. The DFT-calculated structures of the [FHF-]-bearing clusters show that the favored interactions of the anions are with the methynic and acetylenic hydrogen atoms on the imidazolium cation, forming planar structures similar to those observed in the solid state. A second series of abundant negative ions was also formed that contained [SiF5-] together with the imidazolium cation and the fluorohydrogenate anions that originate from reaction of the spray solution with silicate surfaces.

  19. One electron oxygen reduction in room temperature ionic liquids: A comparative study of Butler-Volmer and Symmetric Marcus-Hush theories using microdisc electrodes

    E-Print Network [OSTI]

    Tanner, Eden E L; Barnes, Edward O; Compton, Richard G

    2015-01-01T23:59:59.000Z

    The voltammetry for the reduction of oxygen at a microdisc electrode is reported in two room temperature ionic liquids: 1-butyl-1-methylpyyrolidinium bis(trifluoromethylsulfonyl) imide ([Bmpyrr][NTf2]) and trihexyltetradecylphosphonium bis9trifluoromethylsulfonyl) imide ([P14,6,6,6][NTf2]) at 298 K. Simulated voltammograms using Butler-Volmer theory and Symmetric Marcus-Hush (SMH) theory were compared with experimental data. Butler-Volmer theory consistently provided experimental parameters with a higher level of certainty than SMH theory. A value of solvent reorganisation energy for oxygen reduction in ionic liquids was inferred for the first time as 0.4-0.5 eV, which is attributable to inner-sphere reorganisation with a negligible contribution from solvent reorganisation. The developed Butler-Volmer and Symmetric Marcus-Hush programs are also used to theoretically study the possibility of kinetically limited steady state currents, and to establish an approximate equivalence relationship between microdisc el...

  20. Acidic Ionic Liquid/Water Solution as Both Medium and Proton Source for Electrocatalytic H2 Evolution by [Ni(P2N2)2]2+ Complexes

    SciTech Connect (OSTI)

    Pool, Douglas H.; Stewart, Michael P.; O'Hagan, Molly J.; Shaw, Wendy J.; Roberts, John A.; Bullock, R. Morris; DuBois, Daniel L.

    2012-09-25T23:59:59.000Z

    The electrocatalytic reduction of protons to H2 by [Ni(PPh2NC6H4-hex2)2](BF4)2 (where PPh2NC6H4-hex2 = 1,5-di(4-n-hexylphenyl)-3,7-diphenyl-1,5-diaza-3,7-diphosphacyclooctane) in the highly acidic ionic liquid dibutylformamidium bis(trifluoromethanesulfonyl)amide shows a strong dependence on added water. A turnover frequency of 43,000-53,000 s-1 has been measured for hydrogen production at 25 °C when the mole fraction of water (?H2O) is 0.72. The same catalyst in acetonitrile with added dimethylformamidium trifluoromethanesulfonate and water has a turnover frequency of 720 s?1. Thus the use of an ionic liquid/aqueous solution enhances the observed catalytic rates by more than a factor of 50 compared to acids in traditional organic solvents such as acetonitrile. Complexes [Ni(PPh2NC6H4X2)2](BF4)2 (X = H, OMe, CH2P(O)(OEt)2, Br) are also catalysts in the ionic liquid/water mixture, and the observed catalytic rates correlate with the hydrophobicity of X. This research was supported as part of the Center for Molecular Electrocatalysis, an Energy Frontier Research Center funded by the U.S. Department of Energy, Office of Science, Office of Basic Energy Sciences. Pacific Northwest National Laboratory is operated by Battelle for the U.S. Department of Energy.

  1. A counter-charge layer in generalized solvents framework for electrical double layers in neat and hybrid ionic liquid electrolytes

    SciTech Connect (OSTI)

    Huang, Jingsong [ORNL; Feng, Guang [Clemson University; Sumpter, Bobby G [ORNL; Qiao, Rui [ORNL; Meunier, Vincent [ORNL

    2011-01-01T23:59:59.000Z

    Room-temperature ionic liquids (RTILs) have received significant attention as electrolytes due to a number of attractive properties such as their wide electrochemical windows. Since electrical double layers (EDLs) are the cornerstone for the applications of RTILs in electrochemical systems such as supercapacitors, it is important to develop an understanding of the structure capacitance relationships for these systems. Here we present a theoretical framework termed counter-charge layer in generalized solvents (CGS) for describing the structure and capacitance of the EDLs in neat RTILs and in RTILs mixed with different mass fractions of organic solvents. Within this framework, an EDL is made up of a counter-charge layer exactly balancing the electrode charge, and of polarized generalized solvents (in the form of layers of ion pairs, each of which has a zero net charge but has a dipole moment the ion pairs thus can be considered as a generalized solvent) consisting of all RTILs inside the system except the counter-ions in the counter-charge layer, together with solvent molecules if present. Several key features of the EDLs that originate from the strong ion ion correlation in RTILs, e.g., overscreening of electrode charge and alternating layering of counter-ions and co-ions, are explicitly incorporated into this framework. We show that the dielectric screening in EDLs is governed predominately by the polarization of generalized solvents (or ion pairs) in the EDL, and the capacitance of an EDL can be related to its microstructure with few a priori assumptions or simplifications. We use this framework to understand two interesting phenomena observed in molecular dynamics simulations of EDLs in a neat IL of 1-butyl-3- methylimidazolium tetrafluoroborate ([BMIM][BF4]) and in a mixture of [BMIM][BF4] and acetonitrile (ACN): (1) the capacitance of the EDLs in the [BMIM][BF4]/ACN mixture increases only slightly when the mass fraction of ACN in the mixture increases from zero to 50% although the dielectric constant of bulk ACN is more than two times higher than that of neat [BMIM][BF4]; (2) the capacitance of EDLs near negative electrodes (with BMIM+ ion as the counter-ion) is smaller than that near positive electrodes (with BF4as counter-ion) although the closest approaches of both ions to the electrode surface are nearly identical.

  2. National Clean Energy Business Plan Competition | Department...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Systems developed cutting-edge battery technologies to meet the world's growing energy storage demand. The Polymer Ionic Liquid (PIL) rechargeable lithium battery has...

  3. IMIDAZOLE-BASED IONIC LIQUIDS FOR USE IN POLYMER ELECTROLYTE MEMBRANE FUEL CELLS: EFFECT OF ELECTRON-WITHDRAWING AND ELECTRON-DONATING SUBSTITUENTS

    SciTech Connect (OSTI)

    Chang, E.; Fu, Y.; Kerr, J.

    2009-01-01T23:59:59.000Z

    Current polymer electrolyte membrane fuel cells (PEMFCs) require humidifi cation for acceptable proton conductivity. Development of a novel polymer that is conductive without a water-based proton carrier is desirable for use in automobiles. Imidazole (Im) is a possible replacement for water as a proton solvent; Im can be tethered to the polymer structure by means of covalent bonds, thereby providing a solid state proton conducting membrane where the solvating groups do not leach out of the fuel cell. These covalent bonds can alter the electron availability of the Im molecule. This study investigates the effects of electron-withdrawing and electron-donating substituents on the conductivity of Im complexed with methanesulfonic acid (MSA) in the form of ionic liquids. Due to the changes in the electronegativity of nitrogen, it is expected that 2-phenylimidazole (2-PhIm, electron-withdrawing) will exhibit increased conductivity compared to Im, while 2-methylimidazole (2-MeIm, electron-donating) will exhibit decreased conductivity. Three sets of ionic liquids were prepared at defi ned molar ratios: Im-MSA, 2-PhIm-MSA, and 2-MeIm- MSA. Differential scanning calorimetry (DSC), thermogravimetric analysis (TGA), and 1H-NMR were used to characterize each complex. Impedance analysis was used to determine the conductivity of each complex. Both the 2-PhIm-MSA and 2-MeIm-MSA ionic liquids were found to be less conductive than the Im-MSA complex at base-rich compositions, but more conductive at acid-rich compositions. 1H-NMR data shows a downfi eld shift of the proton on nitrogen in 2-PhIm compared to Im, suggesting that other factors may diminish the electronic effects of the electron withdrawing group at base-rich compositions. Further studies examining these effects may well result in increased conductivity for Im-based complexes. Understanding the conductive properties of Im-derivatives due to electronic effects will help facilitate the development of a new electrolyte appropriate for automotive fuel cell use.

  4. Pd-porphyrin functionalized ionic liquid-modified mesoporous SBA-15: An efficient and recyclable catalyst for solvent-free Heck reaction

    SciTech Connect (OSTI)

    Zhang, Jing; Zhao, Guo-Feng [Shanghai Key Laboratory of Green Chemistry and Chemical Processes, Chemistry Department, East China Normal University, Shanghai 200062 (China)] [Shanghai Key Laboratory of Green Chemistry and Chemical Processes, Chemistry Department, East China Normal University, Shanghai 200062 (China); Popovic, Zora [General and Inorganic Laboratory, Chemistry Department, University of Zagreb, HR-10000 Zagreb (Croatia)] [General and Inorganic Laboratory, Chemistry Department, University of Zagreb, HR-10000 Zagreb (Croatia); Lu, Yong [Shanghai Key Laboratory of Green Chemistry and Chemical Processes, Chemistry Department, East China Normal University, Shanghai 200062 (China)] [Shanghai Key Laboratory of Green Chemistry and Chemical Processes, Chemistry Department, East China Normal University, Shanghai 200062 (China); Liu, Ye, E-mail: yliu@chem.ecnu.edu.cn [Shanghai Key Laboratory of Green Chemistry and Chemical Processes, Chemistry Department, East China Normal University, Shanghai 200062 (China)] [Shanghai Key Laboratory of Green Chemistry and Chemical Processes, Chemistry Department, East China Normal University, Shanghai 200062 (China)

    2010-11-15T23:59:59.000Z

    The Pd-porphyrin functionalized ionic liquid could be covalently anchored in the channels of mesoporous SBA-15 through ion-pair electrostatic interaction between imidazolium-cationic and Pd-porphyrin-anionic moieties. Such modified SBA-15 materials were prepared successfully via a post-synthesis (surface sol-gel polymerization) or a one-pot sol-gel procedure, which were characterized by powder X-ray diffraction, UV-visible spectroscopy, Fourier transform infrared spectroscopy, N{sub 2} sorption, elemental analysis, and transmission electron microscopy. The modified SBA-15 materials are efficient and recyclable catalysts for cross-coupling of aryl iodides or activated aryl bromides with ethyl acrylate without activity loss and Pd leaching even after 9 runs.

  5. Facile preparation of agarose-chitosan hybrid materials and nanocomposite ionogels using an ionic liquid via dissolution, regeneration and sol-gel transition

    E-Print Network [OSTI]

    Trivedi, Tushar J; Kumar, Arvind

    2014-01-01T23:59:59.000Z

    We report simultaneous dissolution of agarose (AG) and chitosan (CH) in varying proportions in an ionic liquid (IL), 1-butyl-3-methylimidazolium chloride [C4mim][Cl]. Composite materials were constructed from AG-CH-IL solutions using the antisolvent methanol, and IL was recovered from the solutions. Composite materials could be uniformly decorated with silver oxide (Ag2O) nanoparticles (Ag NPs) to form nanocomposites in a single step by in situ synthesis of Ag NPs in AG-CH-IL sols, wherein the biopolymer moiety acted as both reducing and stabilizing agent. Cooling of Ag NPs-AG-CH-IL sols to room temperature resulted in high conductivity and high mechanical strength nanocomposite ionogels. The structure, stability and physiochemical properties of composite materials and nanocomposites were characterized by several analytical techniques, such as Fourier transform infrared (FTIR), CD spectroscopy, differential scanning colorimetric (DSC), thermogravimetric analysis (TGA), gel permeation chromatography (GPC), and...

  6. One-pot synthesis of SnO{sub 2}/reduced graphene oxide nanocomposite in ionic liquid-based solution and its application for lithium ion batteries

    SciTech Connect (OSTI)

    Gu, Changdong, E-mail: cdgu@zju.edu.cn; Zhang, Heng; Wang, Xiuli; Tu, Jiangping

    2013-10-15T23:59:59.000Z

    Graphical abstract: - Highlights: • A facile and low-temperature method is developed for SnO{sub 2}/graphene composite. • Synthesis performed in a choline chloride-based ionic liquid. • The composite shows an enhanced cycling stability as anode for Li-ion batteries. • 4 nm SnO{sub 2} nanoparticles mono-dispersed on the surface of reduced graphene oxide. - Abstract: A facile and low-temperature method is developed for SnO{sub 2}/graphene composite which involves an ultrasonic-assistant oxidation–reduction reaction between Sn{sup 2+} and graphene oxide in a choline chloride–ethylene glycol based ionic liquid under ambient conditions. The reaction solution is non-corrosive and environmental-friendly. Moreover, the proposed technique does not require complicated infrastructures and heat treatment. The SnO{sub 2}/graphene composite consists of about 4 nm sized SnO{sub 2} nanoparticles with cassiterite structure mono-dispersed on the surface of reduced graphene oxide. As anode for lithium-ion batteries, the SnO{sub 2}/graphene composite shows a satisfying cycling stability (535 mAh g{sup ?1} after 50 cycles @100 mA g{sup ?1}), which is significantly prior to the bare 4 nm sized SnO{sub 2} nanocrsytals. The graphene sheets in the hybrid nanostructure could provide a segmentation effect to alleviate the volume expansion of the SnO{sub 2} and restrain the small and active Sn-based particles aggregating into larger and inactive clusters during cycling.

  7. Auto Template Assembly of CaCO3-Chitosan Hybrid Nanoboxes and Nanoframes in Ionic Liquid Medium

    E-Print Network [OSTI]

    Chen, Hsingming Anna

    2012-07-16T23:59:59.000Z

    . Consequently, ILs exist in the liquid state at room temperature. ILs have extremely low vapor pressure compared to traditional volatile solvents; this characteristic qualifies them to be categorized as green solvents. Moreover, particular synthesis...

  8. Lithium ion conducting ionic electrolytes

    DOE Patents [OSTI]

    Angell, C.A.; Xu, K.; Liu, C.

    1996-01-16T23:59:59.000Z

    A liquid, predominantly lithium-conducting, ionic electrolyte is described which has exceptionally high conductivity at temperatures of 100 C or lower, including room temperature. It comprises molten lithium salts or salt mixtures in which a small amount of an anionic polymer lithium salt is dissolved to stabilize the liquid against recrystallization. Further, a liquid ionic electrolyte which has been rubberized by addition of an extra proportion of anionic polymer, and which has good chemical and electrochemical stability, is described. This presents an attractive alternative to conventional salt-in-polymer electrolytes which are not cationic conductors. 4 figs.

  9. Lithium ion conducting ionic electrolytes

    DOE Patents [OSTI]

    Angell, C. Austen (Mesa, AZ); Xu, Kang (Tempe, AZ); Liu, Changle (Tulsa, OK)

    1996-01-01T23:59:59.000Z

    A liquid, predominantly lithium-conducting, ionic electrolyte is described which has exceptionally high conductivity at temperatures of 100.degree. C. or lower, including room temperature. It comprises molten lithium salts or salt mixtures in which a small amount of an anionic polymer lithium salt is dissolved to stabilize the liquid against recrystallization. Further, a liquid ionic electrolyte which has been rubberized by addition of an extra proportion of anionic polymer, and which has good chemical and electrochemical stability, is described. This presents an attractive alternative to conventional salt-in-polymer electrolytes which are not cationic conductors.

  10. Final Technical Report: SISGR: The Influence of Electrolyte Structure and Electrode Morphology on the Performance of Ionic-Liquid Based Supercapacitors: A Combined Experimental and Simulation Study

    SciTech Connect (OSTI)

    Bedrov, Dmitry [University of Utah] [University of Utah

    2013-08-15T23:59:59.000Z

    Obtaining fundamental understanding and developing predictive modeling capabilities of electrochemical interfaces can significantly shorten the development cycles of electrical double layer capacitors (EDLCs). A notable improvement in EDLC performance has been achieved due to recent advances in understanding charge storage mechanisms, development of advanced nanostructured electrodes and electrochemically stable electrolytes. The development of new generation of EDLCs is intimately linked to that of nanostructured carbon materials which have large surface area, good adsorption/desorption properties, good electrical conductivity and are relatively inexpensive. To address these scientific challenges the efforts of an interdisciplinary team of modelers and experimentalists were combined to enhance our understanding of molecular level mechanisms controlling the performance of EDLCs comprised of room temperature ionic liquid (RTIL) electrolytes and nanostructured carbon-based electrodes and to utilize these knowledge in the design of a new generation of materials and devices for this energy storage application. Specifically our team efforts included: atomistic molecular dynamics simulations, materials science and electrode/device assembly, and synthesis and characterization of RTIL electrolytes.

  11. Sandia Energy - Biofuels Blend Right In: Researchers Show Ionic...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Biofuels Blend Right In: Researchers Show Ionic Liquids Effective for Pretreating Mixed Blends of Biofuel Feedstocks Home Renewable Energy Energy Transportation Energy Biofuels...

  12. Development of a Conceptual Process for Selective CO{sub 2} Capture from Fuel Gas Streams Using [hmim][Tf2N] Ionic Liquid as a Physical Solvent

    SciTech Connect (OSTI)

    Basha, Omar M.; Keller, Murphy J.; Luebke, David R.; Resnik, Kevin; P Morsi, Badie I.

    2013-07-01T23:59:59.000Z

    The Ionic Liquid (IL) [hmim][Tf2N] was used as a physical solvent in an Aspen Plus simulation, employing the Peng-Robinson Equation of State (P-R EOS) with Boston-Mathias (BM) alpha function and standard mixing rules, to develop a conceptual process for CO{sub 2} capture from a shifted warm fuel gas stream produced from Pittsburgh # 8 coal for a 400 MWe power plant. The physical properties of the IL, including density, viscosity, surface tension, vapor pressure and heat capacity were obtained from literature and modeled as a function of temperature. Also, available experimental solubility values for CO{sub 2}, H{sub 2}, H{sub 2}S, CO, and CH{sub 4} in this IL were compiled and their binary interaction parameters ({delta}{sub ij} and l{sub ij}) were optimized and correlated as functions of temperature. The Span-Wager Equation-of-State EOS was also employed to generate CO{sub 2} solubilities in [hmim][Tf2N] at high pressures (up to 10 MPa) and temperatures (up to 510 K). The conceptual process developed consisted of 4 adiabatic absorbers (2.4 m ID, 30 m high) arranged in parallel and packed with Plastic Pall Rings of 0.025 m for CO{sub 2} capture; 3 flash drums arranged in series for solvent (IL) regeneration with the pressure-swing option; and a pressure-intercooling system for separating and pumping CO{sub 2} up to 153 bar to the sequestration sites. The compositions of all process streams, CO{sub 2} capture efficiency, and net power were calculated using Aspen Plus simulator. The results showed that, based on the composition of the inlet gas stream to the absorbers, 95.67 mol% of CO{sub 2} was captured and sent to sequestration sites; 99.5 mol% of H{sub 2} was separated and sent to turbines; the solvent exhibited a minimum loss of 0.31 mol%; and the net power balance of the entire system was 30.81 MW. These results indicated that [hmim][Tf2N] IL could be used as a physical solvent for CO{sub 2} capture from warm shifted fuel gas streams with high efficiency.

  13. Sandia National Laboratories: ionic liquid

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    News & Events, Partnership, Renewable Energy, Research & Capabilities, Transportation Energy Winemakers have long known that blending different grape varietals can favorably...

  14. High-Resolution Electrospray Ionization Mass Spectrometry Analysis of Water- Soluble Organic Aerosols Collected with a Particle into Liquid Sampler

    SciTech Connect (OSTI)

    Bateman, Adam P.; Nizkorodov, Serguei; Laskin, Julia; Laskin, Alexander

    2010-10-01T23:59:59.000Z

    This work demonstrates the utility of a particle-into-liquid sampler (PILS) a technique traditionally used for identification of inorganic ions present in ambient or laboratory aerosols for the analysis of water soluble organic aerosol (OA) using high resolution electrospray ionization mass spectrometry (HR ESI-MS). Secondary organic aerosol (SOA) was produced from 0.5 ppm mixing ratios of limonene and ozone in a 5 m3 Teflon chamber. SOA was collected simultaneously using a traditional filter sampler and a PILS. The filter samples were later extracted with either water or acetonitrile, while the aqueous PILS samples were analyzed directly. In terms of peak intensities, types of detectable compounds, average O:C ratios, and organic mass to organic carbon ratios, the resulting high resolution mass spectra were essentially identical for the PILS and filter based samples. SOA compounds extracted from both filter/acetonitrile extraction and PILS/water extraction accounted for >95% of the total ion current in ESI mass spectra. This similarity was attributed to high solubility of limonene SOA in water. In contrast, significant differences in detected ions and peak abundances were observed for pine needle biomass burning organic aerosol (BBOA) collected with PILS and filter sampling. The water soluble fraction of BBOA is considerably smaller than for SOA, and a number of unique peaks were detectable only by the filter/acetonitrile method. The combination of PILS collection with HR-ESI-MS analysis offers a new approach for molecular analysis of the water-soluble organic fraction in biogenic SOA, aged photochemical smog, and BBOA.

  15. Partially fluorinated ionic compounds

    DOE Patents [OSTI]

    Han, legal representative, Amy Qi (Hockessin, DE); Yang, Zhen-Yu (Hockessin, DE)

    2008-11-25T23:59:59.000Z

    Partially fluorinated ionic compounds are prepared. They are useful in the preparation of partially fluorinated dienes, in which the repeat units are cycloaliphatic.

  16. Static dielectric properties of dense ionic fluids

    E-Print Network [OSTI]

    Zarubin, Grigory

    2015-01-01T23:59:59.000Z

    The static dielectric properties of dense ionic fluids, e.g., room temperature ionic liquids (RTILs) and inorganic fused salts, are investigated on different length scales by means of grandcanonical Monte Carlo simulations. A generally applicable scheme is developed which allows one to approximately decompose the electric susceptibility of dense ionic fluids into the orientation and the distortion polarization contribution. It is shown that at long range the well-known plasma-like perfect screening behavior occurs, which corresponds to a diverging distortion susceptibility, whereas at short range orientation polarization dominates, which coincides with that of a dipolar fluid of attached cation-anion pairs. This observation suggests that the recently debated interpretation of RTILs as dilute electrolyte solutions might not be simply a yes-no-question but it might depend on the considered length scale.

  17. Preparation of High Purity, High Molecular-Weight Chitin from Ionic Liquids for Use as an Adsorbate for the Extraction of Uranium from Seawater (Workscope MS-FC: Fuel Cycle R&D)

    SciTech Connect (OSTI)

    Rogers, Robin

    2013-12-21T23:59:59.000Z

    Ensuring a domestic supply of uranium is a key issue facing the wider implementation of nuclear power. Uranium is mostly mined in Kazakhstan, Australia, and Canada, and there are few high-grade uranium reserves left worldwide. Therefore, one of the most appealing potential sources of uranium is the vast quantity dissolved in the oceans (estimated to be 4.4 billion tons worldwide). There have been research efforts centered on finding a means to extract uranium from seawater for decades, but so far none have resulted in an economically viable product, due in part to the fact that the materials that have been successfully demonstrated to date are too costly (in terms of money and energy) to produce on the necessary scale. Ionic Liquids (salts which melt below 100{degrees}C) can completely dissolve raw crustacean shells, leading to recovery of a high purity, high molecular weight chitin powder and to fibers and films which can be spun directly from the extract solution suggesting that continuous processing might be feasible. The work proposed here will utilize the unprecedented control this makes possible over the chitin fiber a) to prepare electrospun nanofibers of very high surface area and in specific architectures, b) to modify the fiber surfaces chemically with selective extractant capacity, and c) to demonstrate their utility in the direct extraction and recovery of uranium from seawater. This approach will 1) provide direct extraction of chitin from shellfish waste thus saving energy over the current industrial process for obtaining chitin; 2) allow continuous processing of nanofibers for very high surface area fibers in an economical operation; 3) provide a unique high molecular weight chitin not available from the current industrial process leading to stronger, more durable fibers; and 4) allow easy chemical modification of the large surface areas of the fibers for appending uranyl selective functionality providing selectivity and ease of stripping. The resulting sorbent should prove economically feasible, as well as providing an overall net energy gain.

  18. Charge Compensation in RE3+ (RE = Eu, Gd) and M+ (M = Li, Na, K) Co-Doped Alkaline Earth Nanofluorides Obtained by Microwave Reaction with Reactive Ionic Liquids Leading to Improved Optical Properties

    SciTech Connect (OSTI)

    Lorbeer, C [Ruhr-Universitat Bochum; Behrends, F [Westfalische Wilhelsm-Universitat Munster; Cybinska, J [Ruhr Universitat Bochum; Eckert, H [Westfalische Wilhelsm-Universitat Munster; Mudring, Anja -V [Ames Laboratory

    2014-01-01T23:59:59.000Z

    Alkaline earth fluorides are extraordinarily promising host matrices for phosphor materials with regard to rare earth doping. In particular, quantum cutting materials, which might considerably enhance the efficiency of mercury-free fluorescent lamps or SC solar cells, are often based on rare earth containing crystalline fluorides such as NaGdF4, GdF3 or LaF3. Substituting most of the precious rare earth ions and simultaneously retaining the efficiency of the phosphor is a major goal. Alkaline earth fluoride nanoparticles doped with trivalent lanthanide ions (which are required for the quantum cutting phenomenon) were prepared via a microwave assisted method in ionic liquids. As doping trivalent ions into a host with divalent cations requires charge compensation, this effect was thoroughly studied by powder X-ray and electron diffraction, luminescence spectroscopy and 23Na, 139La and 19F solid state NMR spectroscopy. Monovalent alkali ions were codoped with the trivalent lanthanide ions to relieve stress and achieve a better crystallinity and higher quantum cutting abilities of the prepared material. 19F-magic angle spinning (MAS)-NMR-spectra, assisted by 19F{23Na} rotational echo double resonance (REDOR) studies, reveal distinct local fluoride environments, the populations of which are discussed in relation to spatial distribution and clustering models. In the co-doped samples, fluoride species having both Na+ and La3+ ions within their coordination sphere can be identified and quantified. This interplay of mono- and trivalent ions in the CaF2 lattice appears to be an efficient charge compensation mechanism that allows for improved performance characteristics of such co-doped phosphor materials.

  19. ORNL 2010-G00986/jcn UT-B ID 200902213

    E-Print Network [OSTI]

    type) ·· Electrolytes (fuel cells, sensors, capacitors, metal finishing) ·· Dye-sensitized solar cells-volatility protic ionic liquids (PILs). Protic ionic liquids can be used in proton- exchange membrane fuel cells and in high temperature conditions. This is a particular problem for fuel cell applications, as it reduces

  20. Enhanced Gas Absorption in the Ionic Liquid 1-n-Hexyl-3-methylimidazolium Bis(trifluoromethylsulfonyl)amide ([hmim][Tf{sub 2}N]) Confined in Silica Slit Pores: A Molecular Simulation Study

    SciTech Connect (OSTI)

    Shi, Wei; Luebke, David R.

    2013-05-07T23:59:59.000Z

    Two-dimensional NP{sub xy}T and isostress-osmotic (N{sub 2}P{sub xy}Tf{sub 1}) Monte Carlo simulations were used to compute the density and gas absorption properties of the ionic liquid (IL) 1-n-hexyl-3- methylimidazolium bis(Trifluoromethylsulfonyl)amide ([hmim][Tf{sub 2}N]) confined in silica slit pores (25-45 Å). Self-diffusivity values for both gas and IL were calculated from NVE molecular dynamics simulations using both smooth and atomistic potential models for the silica. Simulations show that the molar volume for [hmim][Tf{sub 2}N] confined in 25-45 Å silica slit pores are 12-31% larger than for the bulk IL at 313-573 K and 1 bar. The amounts of CO{sub 2}, H{sub 2}, and N{sub 2} absorbed in the confined IL are typically 1.1-3 times larger than in the bulk IL due to larger molar volumes for the confined IL compared to the bulk IL. The CO{sub 2}, N{sub 2}, and H{sub 2} molecules are generally absorbed close to the silica wall where the IL density is very low. This arrangement causes the self-diffusivities for these gases in the confined IL to be 2 to 8 times larger than in the bulk IL at 298-573 K. The solubility for water in the confined and bulk ILs are similar, which is likely due to strong water interactions with [hmim][Tf{sub 2}N] through hydrogen-bonding resulting in the confined IL molar volume playing a less important role in determining H{sub 2}O solubility. Water molecules were largely absorbed in the IL-rich region rather than close to the silica wall. The self-diffusivities for water correlate with the confined IL. The confined IL exhibits self-diffusivities larger than the bulk IL at lower temperatures, but smaller than the bulk IL at higher temperatures. The findings from simulations are consistent with available experimental data for similar confined IL systems.

  1. Ionic liquids for rechargeable lithium batteries

    E-Print Network [OSTI]

    Salminen, Justin; Papaiconomou, Nicolas; Kerr, John; Prausnitz, John; Newman, John

    2008-01-01T23:59:59.000Z

    efficiency of dye-sensitized solar cells,’’ J. Phys. Chem.in dye-sensitized nanocrystalline solar cells,’’ J. Phys.

  2. Ionic liquids for rechargeable lithium batteries

    E-Print Network [OSTI]

    Salminen, Justin; Papaiconomou, Nicolas; Kerr, John; Prausnitz, John; Newman, John

    2008-01-01T23:59:59.000Z

    their use in lithium-ion batteries. However, applications atresponse of lithium rechargeable batteries,” Journal of therechargeable lithium batteries (Preliminary report, Sept.

  3. Sandia National Laboratories: ion-ic liquids

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    and NREL Announce Two New H2FIRST Reports New Report Describes Joint Opportunities for Natural Gas and Hydrogen Fuel-Cell Vehicle Markets Sandians Participate in 46th Annual...

  4. Ionic liquids for rechargeable lithium batteries

    E-Print Network [OSTI]

    Salminen, Justin; Papaiconomou, Nicolas; Kerr, John; Prausnitz, John; Newman, John

    2008-01-01T23:59:59.000Z

    conducting polymer electrochromic devices using ionicelectrochemical cells and electrochromic devices, including

  5. Ionic liquids for rechargeable lithium batteries

    E-Print Network [OSTI]

    Salminen, Justin; Papaiconomou, Nicolas; Kerr, John; Prausnitz, John; Newman, John

    2008-01-01T23:59:59.000Z

    for rechargeable lithium batteries (Preliminary report,applications using lithium batteries, we must be sure thattemperature range. For lithium batteries in hybrid vehicles,

  6. Synthesis of Ionic Liquids - Energy Innovation Portal

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level:Energy: Grid Integration Redefining What'sis Taking Over Our InstagramStructureProposed Action(Insert Directive Number andHydrogen and Fuel

  7. Synthesis and physico-chemical properties of ionic liquidscontaining tetrakis(perfluorophenyl)borate, tetraphenylborate andtrifluorophenylborate anions.

    SciTech Connect (OSTI)

    Papaiconomou, Nicolas; Salminen, Justin; Yakelis, Neal; Prausnitz, John M.

    2006-03-01T23:59:59.000Z

    Synthesis and some physico-chemical properties are reported for six new hydrophobic ionic liquids containing tetrakis(perfluorophenyl)borate, tetraphenylborate or trfluorophenylborate anions and imidazolium or pyridinium cations.

  8. ARM - Campaign Instrument - pils

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645 3,625 1,006 492air Comments? We would love to hear from you!jpl Comments? WegovInstrumentsphotoacoustic Comments?

  9. ARM - Instrument - pils

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645 3,625 1,006Datastreamstwrcam40mgovInstrumentsmwr3c Documentation MWR3CgovInstrumentspgs Documentation PGS : Handbook

  10. Super ionic conductive glass

    DOE Patents [OSTI]

    Susman, Sherman (Park Forest, IL); Volin, Kenneth J. (Fort Collins, CO)

    1984-01-01T23:59:59.000Z

    An ionically conducting glass for use as a solid electrolyte in a power or secondary cell containing an alkali metal-containing anode and a cathode separated by an alkali metal ion conducting glass having an ionic transference number of unity and the general formula: A.sub.1+x D.sub.2-x/3 Si.sub.x P.sub.3-x O.sub.12-2x/3, wherein A is a network modifier for the glass and is an alkali metal of the anode, D is an intermediate for the glass and is selected from the class consisting of Zr, Ti, Ge, Al, Sb, Be, and Zn and X is in the range of from 2.25 to 3.0. Of the alkali metals, Na and Li are preferred and of the intermediate, Zr, Ti and Ge are preferred.

  11. Thermodynamic estimation: Ionic materials

    SciTech Connect (OSTI)

    Glasser, Leslie, E-mail: l.glasser@curtin.edu.au

    2013-10-15T23:59:59.000Z

    Thermodynamics establishes equilibrium relations among thermodynamic parameters (“properties”) and delineates the effects of variation of the thermodynamic functions (typically temperature and pressure) on those parameters. However, classical thermodynamics does not provide values for the necessary thermodynamic properties, which must be established by extra-thermodynamic means such as experiment, theoretical calculation, or empirical estimation. While many values may be found in the numerous collected tables in the literature, these are necessarily incomplete because either the experimental measurements have not been made or the materials may be hypothetical. The current paper presents a number of simple and relible estimation methods for thermodynamic properties, principally for ionic materials. The results may also be used as a check for obvious errors in published values. The estimation methods described are typically based on addition of properties of individual ions, or sums of properties of neutral ion groups (such as “double” salts, in the Simple Salt Approximation), or based upon correlations such as with formula unit volumes (Volume-Based Thermodynamics). - Graphical abstract: Thermodynamic properties of ionic materials may be readily estimated by summation of the properties of individual ions, by summation of the properties of ‘double salts’, and by correlation with formula volume. Such estimates may fill gaps in the literature, and may also be used as checks of published values. This simplicity arises from exploitation of the fact that repulsive energy terms are of short range and very similar across materials, while coulombic interactions provide a very large component of the attractive energy in ionic systems. Display Omitted - Highlights: • Estimation methods for thermodynamic properties of ionic materials are introduced. • Methods are based on summation of single ions, multiple salts, and correlations. • Heat capacity, entropy, lattice energy, enthalpy, Gibbs energy values are available.

  12. Examination of the fundamental relation between ionic transport and segmental relaxation in polymer electrolytes

    SciTech Connect (OSTI)

    Wang, Yangyang [ORNL; Fan, Fei [ORNL; Agapov, Alexander L [ORNL; Saito, Tomonori [ORNL; Yang, Jun [ORNL; Yu, Xiang [ORNL; Hong, Kunlun [ORNL; Mays, Jimmy [University of Tennessee, Knoxville (UTK); Sokolov, Alexei P [ORNL

    2014-01-01T23:59:59.000Z

    Replacing traditional liquid electrolytes by polymers will significantly improve electrical energy storage technologies. Despite significant advantages for applications in electrochemical devices, the use of solid polymer electrolytes is strongly limited by their poor ionic conductivity. The classical theory predicts that the ionic transport is dictated by the segmental motion of the polymer matrix. As a result, the low mobility of polymer segments is often regarded as the limiting factor for development of polymers with sufficiently high ionic conductivity. Here, we show that the ionic conductivity in many polymers can be strongly decoupled from their segmental dynamics, in terms of both temperature dependence and relative transport rate. Based on this principle, we developed several polymers with superionic conductivity. The observed fast ion transport suggests a fundamental difference between the ionic transport mechanisms in polymers and small molecules and provides a new paradigm for design of highly conductive polymer electrolytes.

  13. Degradation of Ionic Pathway in PEM Fuel Cell Cathode. | EMSL

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Degradation of Ionic Pathway in PEM Fuel Cell Cathode. Degradation of Ionic Pathway in PEM Fuel Cell Cathode. Abstract: The degradation of the ionic pathway throughout the catalyst...

  14. Aqueous Biphasic Systems Based on Salting-Out Polyethylene Glycol or Ionic Solutions: Strategies for Actinide or Fission Product Separations

    SciTech Connect (OSTI)

    Rogers, Robin D.; Gutowski, Keith E.; Griffin, Scott T.; Holbrey, John D.

    2004-03-29T23:59:59.000Z

    Aqueous biphasic systems can be formed by salting-out (with kosmotropic, waterstructuring salts) water soluble polymers (e.g., polyethylene glycol) or aqueous solutions of a wide range of hydrophilic ionic liquids based on imidazolium, pyridinium, phosphonium and ammonium cations. The use of these novel liquid/liquid biphases for separation of actinides or other fission products associated with nuclear wastes (e.g., pertechnetate salts) has been demonstrated and will be described in this presentation.

  15. Asymmetric Framework for Predicting Liquid-Liquid Equilibrium of Ionic Liquid-Mixed Solvent Systems

    E-Print Network [OSTI]

    Stadtherr, Mark A.

    of multicomponent (ternary) LLE data with conventional excess Gibbs free energy models such as NRTL.6-14 Previously, we have studied15 the capability of such models, specifically NRTL, UNIQUAC and electrolyte-NRTL (eNRTL is the NRTL-SAC (NRTL Segm

  16. Liquid-Liquid Extraction Processes

    E-Print Network [OSTI]

    Fair, J. R.; Humphrey, J. L.

    1983-01-01T23:59:59.000Z

    Liquid-liquid extraction is the separation of one or more components of a liquid solution by contact with a second immiscible liquid called the solvent. If the components in the original liquid solution distribute themselves differently between...

  17. Partially fluorinated cyclic ionic polymers and membranes

    DOE Patents [OSTI]

    Yang, Zhen-Yu

    2013-04-09T23:59:59.000Z

    Ionic polymers are made from selected partially fluorinated dienes, in which the repeat units are cycloaliphatic. The polymers are formed into membranes.

  18. aqueous ionic liquids: Topics by E-print Network

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    The resulting dynamical equations can be written as a gradient flow with a degenerate mobility function. This form of the mobility function gives rise to charging behaviours that...

  19. Molecular dynamics modeling of ionic liquids in electrospray propulsion

    E-Print Network [OSTI]

    Takahashi, Nanako

    2010-01-01T23:59:59.000Z

    Micro-propulsion has been studied for many years due to its applications in small-to-medium sized spacecraft for precise satellite attitude control. Electrospray thrusters are promising thrusters built upon the state of ...

  20. Ion Transport in Nanostructured Block Copolymer/Ionic Liquid Membranes

    E-Print Network [OSTI]

    Hoarfrost, Megan Lane

    2012-01-01T23:59:59.000Z

    14-18 fuel cells, 19-26 dye-sensitized solar cells, 27, 28batteries or dye-sensitized solar cells. 57, 58 PVdF-co-PHFP

  1. Dispenser Printed Zinc Microbattery with an Ionic Liquid Gel Electrolyte

    E-Print Network [OSTI]

    Ho, Christine Chihfan

    2010-01-01T23:59:59.000Z

    Polymer Electrolytes for Lithium-Ion Batteries." Advancedpolymer electrolytes for lithium-ion batteries." Journal ofinclude lithium and lithium-ion chemistries with various

  2. Dispenser Printed Zinc Microbattery with an Ionic Liquid Gel Electrolyte

    E-Print Network [OSTI]

    Ho, Christine Chihfan

    2010-01-01T23:59:59.000Z

    Journal of Microelectromechanical Systems 16, no. 4 (JanMEMS." Journal of Microelectromechanical Systems 14, no. 5 (Journal of Microelectromechanical Systems 14, no. 2 (Jan

  3. Ion Transport in Nanostructured Block Copolymer/Ionic Liquid Membranes

    E-Print Network [OSTI]

    Hoarfrost, Megan Lane

    2012-01-01T23:59:59.000Z

    corrected with the post-ion chamber intensity using Nikawas corrected with the post-ion chamber intensity using Nikacorrected with the post-ion chamber intensity using Nika

  4. Dispenser Printed Zinc Microbattery with an Ionic Liquid Gel Electrolyte

    E-Print Network [OSTI]

    Ho, Christine Chihfan

    2010-01-01T23:59:59.000Z

    Electrically Conductive Oxide Aerogels: New Materials in2003). Electrochemical Properties of Vanadium Oxide Aerogelsand Aerogel Nanocomposites . Journal of Sol-Gel Science and

  5. Ion Transport in Nanostructured Block Copolymer/Ionic Liquid Membranes

    E-Print Network [OSTI]

    Hoarfrost, Megan Lane

    2012-01-01T23:59:59.000Z

    which the corona is small relative to the core, FCC and BCCin which the corona layer is large relative to the core, 14,

  6. Tunable wavelength soft photoionization of ionic liquid vapors

    E-Print Network [OSTI]

    Strasser, Daniel

    2010-01-01T23:59:59.000Z

    Nevertheless, small binding enrgy shifts are evident in thea similar trend of binding enrgy shifts observed for peak

  7. Ion Transport in Nanostructured Block Copolymer/Ionic Liquid Membranes

    E-Print Network [OSTI]

    Hoarfrost, Megan Lane

    2012-01-01T23:59:59.000Z

    J. Journal of Chemical and Engineering Data 2002, 47, (6),Review of Chemical and Biomolecular Engineering, Vol 1 2010,Review of Chemical and Biomolecular Engineering 2010, 1,

  8. Sandia National Laboratories: ionic liquids biological-ly derived...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    and NREL Announce Two New H2FIRST Reports New Report Describes Joint Opportunities for Natural Gas and Hydrogen Fuel-Cell Vehicle Markets Sandians Participate in 46th Annual...

  9. Ionic Liquids as Solvents for Catalytic Conversion of Lignocellulosic Feedstocks

    E-Print Network [OSTI]

    Dee, Sean Joseph

    2012-01-01T23:59:59.000Z

    E. Amonette, Z. C. Zhang, Applied Catalysis a-General 2009,Y. Ma, Y. D. Li, Applied Catalysis a-General 2010, 385, 1-

  10. Ion Transport in Nanostructured Block Copolymer/Ionic Liquid Membranes

    E-Print Network [OSTI]

    Hoarfrost, Megan Lane

    2012-01-01T23:59:59.000Z

    of Hydrogen, Fuel Cell, and Infrastructure Technologies ofof Hydrogen, Fuel Cell, and Infrastructure Technologies ofof Hydrogen, Fuel Cell, and Infrastructure Technologies of

  11. Dispenser Printed Zinc Microbattery with an Ionic Liquid Gel Electrolyte

    E-Print Network [OSTI]

    Ho, Christine Chihfan

    2010-01-01T23:59:59.000Z

    microbatteries on a polyimide substrate. The microbatteriesmm by 3 mm trench into polyimide backed with aluminum, whichresistant substrates such as polyimide are also suitable.

  12. Ionic Liquid Pretreatment Process for Biomass Is Successfully...

    Office of Environmental Management (EM)

    to digest switchgrass biomass and synthesize its sugars into gasoline, diesel and jet fuel. | Image courtesy of Berkeley Lab. Advanced Biofuels: How Scientists are...

  13. Tribological Properties of Ionic Liquids Lubricants Containing Nanoparticles 

    E-Print Network [OSTI]

    Lu, Wei

    2014-05-14T23:59:59.000Z

    O_(2) nanoparticles, and shown that functionalized SiO_(2) nanoparticles led to improved colloidal stability. Friction force profiles, friction coefficients, viscosity behavior, wear behavior of these mixtures at various nanoparticles concentrations...

  14. Dispenser Printed Zinc Microbattery with an Ionic Liquid Gel Electrolyte

    E-Print Network [OSTI]

    Ho, Christine Chihfan

    2010-01-01T23:59:59.000Z

    Glassy materials for lithium batteries: electrochemicalal. "Solid-state microscale lithium batteries prepared withSolid-State Rechargeable Lithium Batteries." Journal of The

  15. Dispenser Printed Zinc Microbattery with an Ionic Liquid Gel Electrolyte

    E-Print Network [OSTI]

    Ho, Christine Chihfan

    2010-01-01T23:59:59.000Z

    using dispenser printing including (a) 3D polymer molds, (b)using dispenser printing including (a) 3D polymer molds, (b)

  16. Dispenser Printed Zinc Microbattery with an Ionic Liquid Gel Electrolyte

    E-Print Network [OSTI]

    Ho, Christine Chihfan

    2010-01-01T23:59:59.000Z

    Fuel Cells, and Supercapacitors? ” Chem. Rev. 104, no. 10 (c-d) of origami folded supercapacitors [In, et al. ,electrodes for thin-film supercapacitors." Journal of Power

  17. Fast diffusion in a room temperature ionic liquid confined in...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    1(a) , E. Mamontov 1 , S. Dai 2 , X. Wang 2(b) , P. F. Fulvio 2 and D. J. Wesolowski 2 1 Neutron Scattering Science Division, Oak Ridge National Laboratory - Oak Ridge, TN 37831,...

  18. Ionic Liquids as Solvents for Catalytic Conversion of Lignocellulosic Feedstocks

    E-Print Network [OSTI]

    Dee, Sean Joseph

    2012-01-01T23:59:59.000Z

    Emim][Cl], 22.0 mg [Emim][Tos] pretreated miscanthus 27.4samples of miscanthus. [Emim][Tos] substrate pretreated ina 10 wt% mixture of [Emim][Tos] in ethylene diamine for 6-10

  19. Dispenser Printed Zinc Microbattery with an Ionic Liquid Gel Electrolyte

    E-Print Network [OSTI]

    Ho, Christine Chihfan

    2010-01-01T23:59:59.000Z

    Ink-jet printed carbon supercapacitor electrodes on gold,Ink-jet printed carbon supercapacitor electrodes on gold,Microcapacitors Thin film supercapacitor (TFSC) research has

  20. Dispenser Printed Zinc Microbattery with an Ionic Liquid Gel Electrolyte

    E-Print Network [OSTI]

    Ho, Christine Chihfan

    2010-01-01T23:59:59.000Z

    and zinc foil electrode. The EIS scans were recorded at theand zinc foil electrode. The EIS scans were recorded at the159 9.3.1 EIS Equivalent Electrical Circuit

  1. Spheroid-Encapsulated Ionic Liquids for Gas Separation - Energy Innovation

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level:Energy: Grid Integration Redefining What'sis Taking Over Our Instagram Secretary900 Special Report: IG-0900Market Luciana

  2. Ionic Liquids as Multifunctional Ashless Additives for Engine Lubrication |

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative Fuels Data Center Home Page on Google Bookmark EERE: Alternative Fuels DataDepartment of Energy Your Density Isn't YourTransport(FactDepartment ofLetter Report: I11IG002RTC3 | 12/1/2014 | © 2014 Robert

  3. Ionic Liquids as Novel Engine Lubricants or Lubricant Additives |

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative Fuels Data Center Home Page on Google Bookmark EERE: Alternative Fuels DataDepartment of Energy Your Density Isn't YourTransport(FactDepartment ofLetter Report: I11IG002RTC3 | 12/1/2014 | © 2014

  4. Ionic Liquids as Novel Lubricants and Additives | Department of Energy

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative Fuels Data Center Home Page on Google Bookmark EERE: Alternative Fuels DataDepartment of Energy Your Density Isn't YourTransport(FactDepartment ofLetter Report: I11IG002RTC3 | 12/1/2014 | © 2014Lubricants and

  5. New Ionic Liquids with Diverse Properties - Energy Innovation Portal

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level:Energy: Grid Integration Redefining What's Possible for Renewable Energy:Nanowire Solar541,9337, 2011R - 445 CU - 2SCIENCENew HardwareStorage

  6. Ultrastable Superbase-Derived Protic Ionic Liquids - Energy Innovation

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level:Energy: Grid Integration Redefining What'sis Taking Over OurThe Iron Spin TransitionProgram |FrankUltrafastHydrogen andPortal Hydrogen

  7. Using Ionic Liquids to Make Titanium Dioxide Nanotubes - Energy Innovation

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level:Energy: Grid Integration Redefining What'sis Taking Over OurThe Iron SpinPrinceton PlasmaAfternoon4.CCSM4large.jpgbriefingUsesUsing DNA

  8. Ionic Liquid Pretreatment Process for Biomass Is Successfully Implemented

    Energy Savers [EERE]

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative Fuels Data Center Home Page onYou are now leaving Energy.gov You are now leaving Energy.gov You are being directed off Energy.gov.Energy02.pdf7 OPAMEnergyInvestigative Report:World Design Challenge |at

  9. New Structure found at Ionic Liquid Surface | Center for Gas

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645 3,625 1,006 492 742EnergyOnItemResearch > The EnergyCenterDioxide CaptureSeeNUCLEARInstrumentsHealthcare

  10. Computational Study of Ionic Liquids | netl.doe.gov

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645U.S. DOEThe Bonneville Power Administration would like submit theInnovationComputational Biology2If you have

  11. Sandia Energy - Biofuels Blend Right In: Researchers Show Ionic Liquids

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645U.S. DOE Office of Scienceand RequirementsCoatings Initiated at PNNL's Sequim Bay Coatings Initiated atEffective

  12. We have created a new family of ionic-liquid

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645U.S. DOE Office of ScienceandMesa del SolStrengthening aTurbulenceUtilizeRural PublicRatesAbout Us >WasteWaterWayne

  13. Project Profile: Thermally-Stable Ionic Liquid Carriers for

    Broader source: Energy.gov (indexed) [DOE]

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645 3,625 1,006 492 742EnergyOn April 23, 2014, an OHASeptember 2010 |of Energy TEES logoSolarEnergy

  14. Carbon Films Produced from Ionic Liquid Precursors - Energy Innovation

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645U.S. DOE Office511041clothAdvanced Materials Advanced. C o w l i t z C o . C l a r8.05CarBen

  15. Thermophilic Cellulases Compatible with Ionic Liquid Pretreatment - Energy

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level:Energy: Grid Integration Redefining What'sis Taking Over OurThe Iron Spin Transition in theTheoretical

  16. Nanoparticle-Enhanced Ionic Liquids (NEILs) - Energy Innovation Portal

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level:Energy: Grid Integration Redefining What's Possible for Renewable Energy: GridTruck

  17. Ionic Liquid Sorbents for Carbon Capture - Energy Innovation Portal

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645U.S. DOEThe Bonneville PowerCherries 82981-1cnHigh SchoolIn12 Investigation Peer Review 2012 May20108899 Site

  18. Ionic Liquids as Lubricants or Additives - Energy Innovation Portal

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645U.S. DOEThe Bonneville PowerCherries 82981-1cnHigh SchoolIn12 Investigation Peer Review 2012 May20108899

  19. Fractionation and Removal of Solutes from Ionic Liquids - Energy Innovation

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645U.S. DOEThe Bonneville Power AdministrationField8,Dist.Newof Energy Forrestal GarageD. Westphal, B.Portal

  20. Inexpensive, Nonfluorinated Anions for Lithium Salts and Ionic Liquids for

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative Fuels Data Center Home Page on Google Bookmark EERE: Alternative Fuels DataDepartment of Energy Your Density Isn't YourTransport(Fact Sheet),EnergyImprovementINDIAN COUNTRYBarriersPipeline ResearchSalts

  1. Multilayered YSZ/GZO films with greatly enhanced ionic conduction...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    YSZGZO films with greatly enhanced ionic conduction for low temperature solid oxide fuel cells. Multilayered YSZGZO films with greatly enhanced ionic conduction for low...

  2. Infrared spectroscopy of ionic clusters

    SciTech Connect (OSTI)

    Price, J.M. (California Univ., Berkeley, CA (USA). Dept. of Chemistry Lawrence Berkeley Lab., CA (USA))

    1990-11-01T23:59:59.000Z

    This thesis describes new experiments wherein the infrared vibrational predissociation spectra of a number of mass-selected ionic cluster systems have been obtained and analyzed in the 2600 to 4000 cm{sup {minus}1} region. The species studied include: the hydrated hydronium ions, H{sub 3}O{sup +} (H{sub 2}O){sub 3 {minus}10}, ammoniated ammonium ions, NH{sub 4}{sup +}(NH{sub 3}){sub 1 {minus}10} and cluster ions involving both water and ammonia around an ammonium ion core, (mixed clusters) NH{sub 4}{sup +}(NH{sub 3}){sub n}(H{sub 2}O){sub m} (n+m=4). In each case, the spectra reveal well resolved structures that can be assigned to transitions arising from the vibrational motions of both the ion core of the clusters and the surrounding neutral solvent molecules. 154 refs., 19 figs., 8 tabs.

  3. Ionic conductors for solid oxide fuel cells

    DOE Patents [OSTI]

    Krumpelt, Michael (Naperville, IL); Bloom, Ira D. (Bolingbrook, IL); Pullockaran, Jose D. (Hanover Park, IL); Myles, Kevin M. (Downers Grove, IL)

    1993-01-01T23:59:59.000Z

    An electrolyte that operates at temperatures ranging from 600.degree. C. to 800.degree. C. is provided. The electrolyte conducts charge ionically as well as electronically. The ionic conductors include molecular framework structures having planes or channels large enough to transport oxides or hydrated protons and having net-positive or net-negative charges. Representative molecular framework structures include substituted aluminum phosphates, orthosilicates, silicoaluminates, cordierites, apatites, sodalites, and hollandites.

  4. Alteration of gas phase ion polarizabilities upon hydration in high dielectric liquids

    E-Print Network [OSTI]

    Sahin Buyukdagli; Tapio Ala-Nissila

    2013-04-23T23:59:59.000Z

    We investigate the modification of gas phase ion polarizabilities upon solvation in polar solvents and ionic liquids. To this aim, we develop a classical electrostatic theory of charged liquids composed of solvent molecules modeled as finite size dipoles, and embedding polarizable ions that consist of Drude oscillators. In qualitative agreement with ab-initio calculations of polar solvents and ionic liquids, the hydration energy of a polarizable ion in both type of dielectric liquid is shown to favor the expansion of its electronic cloud. Namely, the ion carrying no dipole moment in the gas phase acquires a dipole moment in the liquid environment, but its electron cloud also reaches an enhanced rigidity. We find that the overall effect is an increase of the gas phase polarizability upon hydration. In the specific case of ionic liquids, it is shown that this hydration process is driven by a collective solvation mechanism where the dipole moment of a polarizable ion induced by its interaction with surrounding ions self-consistently adds to the polarization of the liquid, thereby amplifying the dielectric permittivity of the medium in a substantial way. We propose this self-consistent hydration as the underlying mechanism behind the high dielectric permittivities of ionic liquids composed of small charges with negligible gas phase dipole moment. Hydration being a correlation effect, the emerging picture indicates that electrostatic correlations cannot be neglected in polarizable liquids.

  5. Integrated experimental and modeling study of the ionic conductivity...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    modeling study of the ionic conductivity of samaria-doped ceria thin films. Abstract: Oxygen diffusion and ionic conductivity of samaria-doped ceria (SDC) thin films have been...

  6. Thermal and structural properties of ionic fluids

    E-Print Network [OSTI]

    Hendrik Bartsch; Oliver Dannenmann; Markus Bier

    2015-05-04T23:59:59.000Z

    The electrostatic interaction in ionic fluids is well-known to give rise to a characteristic phase behavior and structure. Sometimes its long range is proposed to single out the electrostatic potential over other interactions with shorter ranges. Here the importance of the range for the phase behavior and the structure of ionic fluids is investigated by means of grandcanonical Monte Carlo simulations of the lattice restricted primitive model (LRPM). The long-ranged electrostatic interaction is compared to various types of short-ranged potentials obtained by sharp and/or smooth cut-off schemes. Sharply cut off electrostatic potentials are found to lead to a strong dependence of the phase behavior and the structure on the cut-off radius. However, when combined with a suitable additional smooth cut-off, the short-ranged LRPM is found to exhibit quantitatively the same phase behavior and structure as the conventional long-ranged LRPM. Moreover, the Stillinger-Lovett perfect screening property, which is well-known to be generated by the long-ranged electrostatic potential, is also fulfilled by short-ranged LRPMs with smooth cut-offs. By showing that the characteristic phase behavior and structure of ionic fluids can also be found in systems with short-ranged potentials, one can conclude that the decisive property of the electrostatic potential in ionic fluids is not the long range but rather the valency dependence.

  7. Asymmetric Framework for Predicting Liquid-Liquid Equilibrium of Ionic Liquid-Mixed Solvent Systems: II. Prediction of Ternary Systems

    E-Print Network [OSTI]

    Stadtherr, Mark A.

    as to predictions obtained from standard symmetric models. Results indicate that an asymmetric NRTL/eNRTL model parameters are needed are the conventional (symmetric) NRTL, electrolyte-NRTL (eNRTL) and UNIQUAC models and the new asymmetric NRTL/eNRTL model. 2.1 Fully Adjustable Parameters For each of the models considered, we

  8. Effect of Ferroelectric Polarization on Ionic Transport and Resistance ...

    E-Print Network [OSTI]

    2014-07-18T23:59:59.000Z

    reliability of ceramic capacitors emerges as a critical chal- lenge when operation ... On the other hand, mathematical models of ionic/electronic defect transport ...

  9. Final Report for DE-FG02-93ER14376,Ionic Transport in Electrochemical Media

    SciTech Connect (OSTI)

    J. W. Halley

    2009-05-20T23:59:59.000Z

    This project was a molecular dynamics study of the relevant issues associated with the structure and transport of lithium in polymer electrolytes such as polyethylene oxide(PEO). In close collaboration with quantum chemist Larry Curtiss and neutron scatterers David Lee Price and Marie-Louise Saboungi at Argonne, we used molecular dynamics to study the local structure and dynamics and ion transport in the polymer. The studies elucidated the mechanism of Li transport in PEO, revealing that the rate limiting step is extremely sensitive to the magnitude of the torsion forces in the backbone of the polymer. Because the torsion forces are difficult to manipulate chemically, this makes it easier to understand why improving the conductivity of PEO based electrolytes has proven to be very difficult. We studied the transport properties of cations in ionic liquids as possible additives to polymer membranes for batteries and fuel cells and found preliminary indications that the transport is enhanced near phase separation in acid-ionic liquid mixtures.

  10. Ionic Power Systems Ltd | Open Energy Information

    Open Energy Info (EERE)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative Fuels Data Center Home Page onYou are now leaving Energy.gov You are now leaving Energy.gov You are8COaBulkTransmissionSitingProcess.pdfGetecGtelInterias Solar Energy Jump to:IESInterval DataCalifornia:PowerIonic

  11. INVESTIGATION OF IONIC CONTAMINATION REMOVAL FROM SILICON DIOXIDE SURFACES

    E-Print Network [OSTI]

    Suni, Ian Ivar

    INVESTIGATION OF IONIC CONTAMINATION REMOVAL FROM SILICON DIOXIDE SURFACES H. Lin, A. A. Busnaina, and I. I. Suni T he removal of ionic contaminants from silicon surfaces surface contamination level canM Communications L td. INTRODUCTION with increasing frequency and power, and decreases Contamination removal is one

  12. Electrochromic device with a polymer ionic conductor

    SciTech Connect (OSTI)

    Zhou, Y.; Gu, P.; Tang, J. [Zhejiang Univ., Hangzhou (China). Dept. of Optical Engineering

    1993-12-31T23:59:59.000Z

    An electrochromic material is one which can undergo a reversible color change on the exertion of an external electric field. This can be used for large-area glazings of future buildings, automobiles, aircrafts, etc. Transmittance control of the smart windows can be useful to reduce lighting, heating and cooling energy loads. The optical and electrochromic properties of tungsten oxide films deposited by e-beam evaporation were investigated. A laminated structure device was prepared. The as-deposited tungsten oxide film was used as the electrochromic film. A solid polymer electrolyte PPG-PMMA-LiClO{sub 4} was used as an ionic conductor. Spectrophotometric measurements show that the luminous transmittance of the device can be modulated between about 60% and 15%.

  13. Structural simulations of nanomaterials self-assembled from ionic macrocycles.

    SciTech Connect (OSTI)

    van Swol, Frank B.; Medforth, Craig John (University of New Mexico, Albuquerque, NM)

    2010-10-01T23:59:59.000Z

    Recent research at Sandia has discovered a new class of organic binary ionic solids with tunable optical, electronic, and photochemical properties. These nanomaterials, consisting of a novel class of organic binary ionic solids, are currently being developed at Sandia for applications in batteries, supercapacitors, and solar energy technologies. They are composed of self-assembled oligomeric arrays of very large anions and large cations, but their crucial internal arrangement is thus far unknown. This report describes (a) the development of a relevant model of nonconvex particles decorated with ions interacting through short-ranged Yukawa potentials, and (b) the results of initial Monte Carlo simulations of the self-assembly binary ionic solids.

  14. Decoupling of Ionic Trasport from Segmental Relaxation in Polymer Electrolytes

    SciTech Connect (OSTI)

    Wang, Yangyang [ORNL; Agapov, Alexander L [ORNL; Fan, Fei [ORNL; Hong, Kunlun [ORNL; Yu, Xiang [ORNL; Mays, Jimmy [ORNL; Sokolov, Alexei P [ORNL

    2012-01-01T23:59:59.000Z

    We present detailed studies of the relationship between ionic conductivity and segmental relaxation in polymer electrolytes. The analysis shows that the ionic conductivity can be decoupled from segmental dynamics and the strength of the decoupling correlates with the fragility but not with the glass transition temperature. These results call for a revision of the current picture of ionic transport in polymer electrolytes. We relate the observed decoupling phenomenon to frustration in packing of rigid polymers, where the loose local structure is also responsible for the increase in their fragility.

  15. Electric Double-Layer Capacitor Based on an Ionic Clathrate Hydrate

    SciTech Connect (OSTI)

    Lee, Wonhee; Kwon, Minchul; Park, Seongmin; Lim, Dongwook Cha, Dr Jong-Ho; Lee, Dr. Huen

    2013-07-01T23:59:59.000Z

    Herein, we suggest a new approach to an electric double-layer capacitor (EDLC) that is based on a proton-conducting ionic clathrate hydrate (ICH). The ice-like structures of clathrate hydrates, which are comprised of host water molecules and guest ions, make them suitable for applications in EDLC electrolytes, owing to their high proton conductivities and thermal stabilities. The carbon materials in the ICH Me{sub 4}NOH[DOT OPERATOR]5?H{sub 2}O show a high specific capacitance, reversible charge–discharge behavior, and a long cycle life. The ionic-hydrate complex provides the following advantages in comparison with conventional aqueous and polymer electrolytes: 1)?The ICH does not cause leakage problems under normal EDLC operating conditions. 2)?The hydrate material can be utilized itself, without requiring any pre-treatments or activation for proton conduction, thus shortening the preparation procedure of the EDLC. 3)?The crystallization of the ICH makes it possible to tailor practical EDLC dimensions because of its fluidity as a liquid hydrate. 4)?The hydrate solid electrolyte exhibits more-favorable electrochemical stability than aqueous and polymer electrolytes. Therefore, ICH materials are expected to find practical applications in versatile energy devices that incorporate electrochemical systems.

  16. Liquid electrode

    DOE Patents [OSTI]

    Ekechukwu, Amy A. (Augusta, GA)

    1994-01-01T23:59:59.000Z

    A dropping electrolyte electrode for use in electrochemical analysis of non-polar sample solutions, such as benzene or cyclohexane. The liquid electrode, preferably an aqueous salt solution immiscible in the sample solution, is introduced into the solution in dropwise fashion from a capillary. The electrolyte is introduced at a known rate, thus, the droplets each have the same volume and surface area. The electrode is used in making standard electrochemical measurements in order to determine properties of non-polar sample solutions.

  17. Liquid electrode

    DOE Patents [OSTI]

    Ekechukwu, A.A.

    1994-07-05T23:59:59.000Z

    A dropping electrolyte electrode is described for use in electrochemical analysis of non-polar sample solutions, such as benzene or cyclohexane. The liquid electrode, preferably an aqueous salt solution immiscible in the sample solution, is introduced into the solution in dropwise fashion from a capillary. The electrolyte is introduced at a known rate, thus, the droplets each have the same volume and surface area. The electrode is used in making standard electrochemical measurements in order to determine properties of non-polar sample solutions. 2 figures.

  18. Phytoremediation of ionic and methyl mercury pollution

    SciTech Connect (OSTI)

    Meagher, R.B.

    1998-06-01T23:59:59.000Z

    'The long-term objective of the research is to manipulate single-gene traits into plants, enabling them to process heavy metals and remediate heavy-metal pollution by resistance, sequestration, removal, and management of these contaminants. The authors are focused on mercury pollution as a case study of this plant genetic engineering approach. The working hypothesis behind this proposal was that transgenic plants expressing both the bacterial organo mercury lyase (merB) and the mercuric ion reductase gene (merA) will: (A) remove the mercury from polluted sites and (B) prevent methyl mercury from entering the food chain. The results from the research are so positive that the technology will undoubtedly be applied in the very near future to cleaning large mercury contaminates sites. Many such sites were not remediable previously due to the excessive costs and the negative environmental impact of conventional mechanical-chemical technologies. At the time this grant was awarded 20 months ago, the authors had successfully engineered a small model plant, Arabidopsis thaliana, to use a highly modified bacterial mercuric ion reductase gene, merA9, to detoxify ionic mercury (Hg(II)), reducing it to much less toxic and volatile metallic Hg(0) (Rugh et al., 1996). Seeds from these plants germinate, grow, and set seed at normal growth rates on levels of Hg(II) that are lethal to normal plants. In assays on transgenic seedlings suspended in a solution of Hg(II), 10 ng of Hg(0) was evolved per min per mg wet weight of plant tissue. At that time, the authors had no information on expression of merA in any other plant species, nor had the authors tested merB in any plant. However, the results were so startlingly positive and well received that they clearly presaged a paradigm shift in the field of environmental remediation.'

  19. Liquid foams of graphene

    E-Print Network [OSTI]

    Alcazar Jorba, Daniel

    2012-01-01T23:59:59.000Z

    Liquid foams are dispersions of bubbles in a liquid. Bubbles are stabilized by foaming agents that position at the interface between the gas and the liquid. Most foaming agents, such as the commonly used sodium dodecylsulfate, ...

  20. Chromatin Ionic Atmosphere Analyzed by a Mesoscale Electrostatic Hin Hark Gan

    E-Print Network [OSTI]

    Schlick, Tamar

    Chromatin Ionic Atmosphere Analyzed by a Mesoscale Electrostatic Approach Hin Hark Gan and Tamar an electrostatic model to handle multivalent ions and compute the ionic distribution around a mesoscale chromatin

  1. ZnS Thin Films Deposited by a Spin Successive Ionic Layer Adsorption...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    ZnS Thin Films Deposited by a Spin Successive Ionic Layer Adsorption and Reaction Process. ZnS Thin Films Deposited by a Spin Successive Ionic Layer Adsorption and Reaction...

  2. Conductive Filler Morphology Effect on Performance of Ionic Polymer Conductive Network Composite Actuators

    E-Print Network [OSTI]

    Liu, Sheng

    Several generations of ionic polymer metal composite (IPMC) actuators have been developed since 1992. It has been discovered that the composite electrodes which are composed of electronic and ionic conductors, have great ...

  3. ENVIRONMENTAL BIOTECHNOLOGY Electricity generation at high ionic strength in microbial fuel

    E-Print Network [OSTI]

    Sun, Baolin

    ENVIRONMENTAL BIOTECHNOLOGY Electricity generation at high ionic strength in microbial fuel cell-Verlag 2009 Abstract Increasing the ionic strength of the electrolyte in a microbial fuel cell (MFC) can in some MFC applications. Keywords Microbial fuel cell . Shewanella marisflavi . Ionic strength . Internal

  4. Selective extraction of copper, mercury, silver and palladium ions from water using hydrophobic ionic liquids.

    E-Print Network [OSTI]

    Papaiconomou, Nicolas; Lee, Jong-Min; Salminen, Justin; Von Stosch, Moritz; Prausnitz, John M.

    2008-01-01T23:59:59.000Z

    2003, 488, 183. (15) Bartsch, R. A. ; Chun, S. ; Dzyuba, S.818, pp 58-68, 2002. (16) Bartsch, R. A. ; Surowiec, K. ;

  5. Separable fluorous ionic liquids for the dissolution and saccharification of cellulose

    E-Print Network [OSTI]

    Raines, Ronald T.

    Cellulose (medium cotton linters, C6288) was from Sigma Chemical (St. Louis, MO). Other commercial chemicals silica gel was from Aldrich Chemical (Milwaukee, WI). The term "concentrated under reduced pressure unless indicated otherwise. Mass spectrometry was performed with a Micromass LCT (electrospray ionization

  6. Ionic Liquids as Multi-Functional Lubricant Additives to Enhance Engine Efficiency

    Broader source: Energy.gov [DOE]

    2013 DOE Hydrogen and Fuel Cells Program and Vehicle Technologies Program Annual Merit Review and Peer Evaluation Meeting

  7. Studies of Block Copolymer Thin Films and Mixtures with an Ionic Liquid

    E-Print Network [OSTI]

    Virgili, Justin

    2009-01-01T23:59:59.000Z

    based natural materials, 4 dye-sensitized solar cells, 5 andcells, 4-8 and dye-sensitized solar cells. 9-12 While the

  8. Ionic liquid assisted electrospinning of quantum dots/elastomer composite Jiahua Zhu a

    E-Print Network [OSTI]

    Guo, John Zhanhu

    ,* a Integrated Composites Laboratory (ICL), Dan F. Smith Department of Chemical Engineering, Lamar University, Beaumont, TX 77710, USA b Department of Chemistry and Biochemistry, Lamar University, Beaumont, TX 77710, USA c Department of Biology, Lamar University, Beaumont, TX 77710, USA d Ocean NanoTech, LLC, 2143

  9. Investigations into the Synthesis, Identification and Developability of Active Ionic Liquids

    E-Print Network [OSTI]

    Miller, Elise

    2012-12-31T23:59:59.000Z

    ; isothermal hold for 2 min.; modulate +/- 0.5°C every 60 sec; ramp 2°C /min to 100°C; mark end of cycle 1; ramp 5°C /min to -20°C; repeat isothermal hold and modulated ramp for two more cycles, with data sampling at 0.20 sec/point. Cycle 1 data was reported....0 g of sodium chloride and 16.8 mL of 1.0N HCl to a 1L bottle and diluting to 1.0 L with deionized water. Fasted State Simulated Intestinal Fluid (FaSSIF) was prepared by diluting 2.24 g of Phares Standard Intestinal Fluid (SIF) powder to 1.0 L...

  10. Homogeneous Hydrogenation of CO? to Methyl Formate Utilizing Switchable Ionic Liquids

    SciTech Connect (OSTI)

    Yadav, Mahendra; Linehan, John C.; Karkamkar, Abhijeet J.; Van Der Eide, Edwin F.; Heldebrant, David J.

    2014-09-15T23:59:59.000Z

    Capture of CO? and subsequent hydrogenation allows for base/alcohol-catalyzed conversion of CO? to methylformate in one pot. The conversion of CO? proceeds via alkylcarbonates, to formate salts and then formate esters, which can be catalyzed by base and alcohol with the only byproduct being water. The system operates at mild conditions (300 psi H?, 140 °C). Reactivity is strongly influenced by temperature and choice of solvent. In the presence of excess of base (DBU) formate is predominant product while in excess of methanol methyl formate is major product. 110 °C yields formate salts, 140 °C promotes methylformate. The authors acknowledge internal Laboratory Directed Re-search and Development (LDRD) funding from Pacific Northwest National Laboratory (PNNL). PNNL is operated by Battelle for the U.S. Department of Energy.

  11. Ionic Liquids as an Attractive Alternative Solvent for Thermal Lens Measurements

    E-Print Network [OSTI]

    Reid, Scott A.

    in volatile organic solvents such as benzene, carbon tetrachloride, and hexane. However, the ILs are more,2 Nonpolar, volative organic solvents such as benzene, carbon tetrachloride, and hexane should provide good

  12. Gas Hydrate Equilibrium Measurements for Multi-Component Gas Mixtures and Effect of Ionic Liquid Inhibitors 

    E-Print Network [OSTI]

    Othman, Enas Azhar

    2014-04-07T23:59:59.000Z

    Qatar holds the world's third-largest proven reserves of natural gas at 885 trillion cubic feet according to a recent report. Because of its desert climate, gas hydrate formation may seem an unlikely event in Qatar. However, ...

  13. Studies of Block Copolymer Thin Films and Mixtures with an Ionic Liquid

    E-Print Network [OSTI]

    Virgili, Justin

    2009-01-01T23:59:59.000Z

    in which the corona is small relative to the core, FCC- andin which the corona layer is large relative to the core, 17,

  14. Characterization of ionic liquid ion sources for focused ion beam applications

    E-Print Network [OSTI]

    Perez Martinez, Carla S. (Carla Sofia)

    2013-01-01T23:59:59.000Z

    In the Focused Ion Beam (FIB) technique, a beam of ions is reduced to nanometer dimensions using dedicated optics and directed to a substrate for patterning. This technique is widely used in micro- and nanofabrication for ...

  15. Identification of a haloalkaliphilic and thermostable cellulase with improved ionic liquid tolerance

    E-Print Network [OSTI]

    Zhang, Tao

    2012-01-01T23:59:59.000Z

    acetate ([Emim]Ac), 1-ethyl-3-methylimidazolium chloride ([Emim]Cl), 1-butyl-3-methylimidazolium chloride ([Bmim]Cl) and 1-allyl-

  16. Project Profile: Thermally-Stable Ionic Liquid Carriers forNanopartic...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Carriers for Nanoparticle-Based Heat Transfer in CSP Applications SRNL logo Savannah River National Laboratory, under an ARRA CSP Award, is performing research to better...

  17. In-situ Analysis of Zinc Electrodeposition within an Ionic Liquid Electrolyte

    E-Print Network [OSTI]

    Keist, Jayme

    2013-01-01T23:59:59.000Z

    chloride low temperature molten salt. Electrochimica Acta,room temperature molten salt. Journal of the Electrochemical

  18. Computer simulations of ionic liquids at electrochemical interfaces C. Merlet1,2

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    emphasizing the case of elec- trical double layer capacitors (EDLC), which has at- tracted much attention

  19. Recovery of Sugars from Ionic Liquid Biomass Liquor by Solvent Extraction

    E-Print Network [OSTI]

    Brennan, Timothy C.; Datta, Supratim; Blanch, Harvey W.; Simmons, Blake A.; Holmes, Bradley M.

    2010-01-01T23:59:59.000Z

    in the IL/ water phase before extraction was 10 mM and atin the IL/ water phase before extraction was 10 mM and atin the IL/ water phase before extraction was 10 mM and at

  20. The Role of Confined Water in Ionic Liquid Electrolytes for Dye-Sensitized Solar Cells

    E-Print Network [OSTI]

    Goddard III, William A.

    for improving the performance of IL DSSC by replacing water with additives that would play the same role Structure, Quantum Chemistry,General Theory The dye-sensitized solar cell (DSSC) proposed by Gratzel et al.1, and nonflammable. However, with current ILs, the DSSC performance is degraded due to decreased reductant rates

  1. Force microscopy of layering and friction in an ionic liquid Judith Hotha,b

    E-Print Network [OSTI]

    Mueser, Martin

    shape of the force vs. distance curve is explained by a model for the interaction between tip, gold of the compliant force sensor between branches of the oscillatory force curve. Frictional force between-viscosity, yet load- bearing lubricant [1-4]. The load-bearing ability stems from the formation of solvation

  2. Effect of Titanium Substitution on the Compatiblity of Electrodes with Pyrrolidinium-Based Ionic Liquid Electrolytes

    E-Print Network [OSTI]

    Saint, Juliette A.; Shin, Joon-Ho; Best, Adam; Hollenkamp, Anthony; Kerr, John; Doeff, Marca M.

    2008-01-01T23:59:59.000Z

    part of the manganese for titanium [Figure References: [1]Effect of Titanium Substitution on the Compatibility of

  3. Studies of ionic liquids in lithium-ion battery test systems

    E-Print Network [OSTI]

    Salminen, Justin; Prausnitz, John M.; Newman, John

    2006-01-01T23:59:59.000Z

    are not useful for lithium batteries. We are therefore nowapplications using lithium batteries, we must be sure thattemperature range. For lithium batteries in hybrid vehicles,

  4. Energy applications of ionic liquids Douglas R. MacFarlane,*a

    E-Print Network [OSTI]

    Angell, C. Austen

    the possibility of designing ideal electrolytes for batteries, super-capacitors, actuators, dye sensitised solar

  5. High-Performance Supercapacitors Based on Poly(ionic liquid)-Modified

    E-Print Network [OSTI]

    - pected for an ideal graphene-based super- capacitor.6 Moreover, current supercapaci- tors have energy for super- capacitors assembled with graphene-based electrodes. One of the challenges is achiev- ing-layer capacitors or ultracapac- itors) are electrochemical capacitors that store energy through reversible ion ad

  6. Inexpensive, Nonfluorinated (or Partially Fluorinated) Anions for Lithium Salts and Ionic Liquids for Lithium Battery Electrolytes

    Broader source: Energy.gov [DOE]

    2013 DOE Hydrogen and Fuel Cells Program and Vehicle Technologies Program Annual Merit Review and Peer Evaluation Meeting

  7. Overscreening in a 1D lattice Coulomb gas model of ionic liquids

    E-Print Network [OSTI]

    Podgornik, Rudolf

    Compilation Index Visit the EPL website to read the latest articles published in cutting-edge fields-review process, from selection of the referees to making all final acceptance decisions Impact Factor ­ The 2010 Impact Factor is 2.753; your work will be in the right place to be cited by your peers Speed

  8. Synthesis of three advanced biofuels from ionic liquid-pretreated switchgrass using engineered Escherichia coli

    E-Print Network [OSTI]

    Bokinsky, Gregory

    One approach to reducing the costs of advanced biofuel production from cellulosic biomass is to engineer a single microorganism to both digest plant biomass and produce hydrocarbons that have the properties of petrochemical ...

  9. Solubility and Aggregation of Charged Surfactants in Ionic Liquids Lang G. Chen and Harry Bermudez*

    E-Print Network [OSTI]

    of ILs are also of central importance in applications such as lubrication, (heterogeneous) catalysis

  10. Technical Highlights for July 2012 New Collaboration Underway to Investigate Ionic Liquids for Enhancing Engine Efficiency

    E-Print Network [OSTI]

    for Enhancing Engine Efficiency A new Cooperative Research and Development Agreement (CRADA), No. NFE-12

  11. Instructions for use Dielectric spectroscopy study on ionic liquid microemulsion composed of

    E-Print Network [OSTI]

    Tsunogai, Urumu

    and the versatility of mi- croemulsion. In addition to the "green solvents" nature, ILs are also known as "designer

  12. Gas Hydrate Equilibrium Measurements for Multi-Component Gas Mixtures and Effect of Ionic Liquid Inhibitors

    E-Print Network [OSTI]

    Othman, Enas Azhar

    2014-04-07T23:59:59.000Z

    hydrate inhibition data from a newly commissioned micro bench top reactor, a high-pressure autoclave and a rocking cell. The conditions for hydrate formation for pure methane and carbon dioxide were also measured, for validation purposes. The measured data...

  13. Theoretical Investigations on Nanoporpus Materials and Ionic Liquids for Energy Storage

    E-Print Network [OSTI]

    Mani Biswas, Mousumi

    2012-02-14T23:59:59.000Z

    In the current context of rapidly depleting petroleum resources and growing environmental concerns, it is important to develop materials to harvest and store energy from renewable and sustainable sources. Hydrogen has the potential...

  14. An Insight of Combustibility Induced Safety Issues Pertaining to Ionic Liquids

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    scenario is also illustrated. This case study is examined in terms of fire induced toxicity by use of CFD conversion and storage [1], biomass pre-treatment [2], metal processing [3], engineering fluids [4

  15. New lithium-based ionic liquid electrolytes that resist salt concentration

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative Fuels Data Center Home Page on Google Bookmark EERE: Alternative Fuels DataDepartment of Energy Your Density Isn'tOrigin of Contamination in Many DevilsForumEngines |NewState Energy ResearchFueling

  16. Visualization of biomass solubilization and cellulose regeneration during ionic liquid pretreatment of switchgrass

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level:Energy: Grid Integration Redefining What'sis Taking Over OurThe Iron SpinPrincetonUsing Maps1 - USAFofEmailNORDUnet,govVisitorARTICLE

  17. Surface layering and melting in an ionic liquid studied by resonant soft

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645 3,625 1,006 492 742EnergyOnItemResearch >Internship Program The NIF and Photon Science|StoriesTechnologiesX-ray

  18. Toward a Materials Genome Approach for Ionic Liquids: Synthesis Guided by

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645 3,625 1,006 492 742EnergyOnItemResearch >Internship Program The NIF andPointsThrust 1: StructureToday HistoryAb

  19. Understanding the effect of side groups in ionic liquids on carbon-capture

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645 3,625 1,006 492 742EnergyOnItemResearch >Internship Program TheSite Map Site Map HomeUSSites |

  20. Ionic Liquids Used as Wear Reduction, Wins R&D 100 Award | Department of

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645U.S. DOEThe Bonneville PowerCherries 82981-1cnHigh SchoolIn12 Investigation Peer Review 2012 May20108899 SiteEnergy

  1. Ionic Liquids as New Solvents for Improved Separation of Medical Isotopes -

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645U.S. DOEThe Bonneville PowerCherries 82981-1cnHigh SchoolIn12 Investigation Peer Review 2012 May20108899Energy Innovation

  2. Safetygram #9- Liquid Hydrogen

    Broader source: Energy.gov [DOE]

    Hydrogen is colorless as a liquid. Its vapors are colorless, odorless, tasteless, and highly flammable.

  3. Liquid Hydrogen Absorber for MICE

    E-Print Network [OSTI]

    Ishimoto, S.

    2010-01-01T23:59:59.000Z

    REFERENCES Figure 5: Liquid hydrogen absorber and test6: Cooling time of liquid hydrogen absorber. Eight CernoxLIQUID HYDROGEN ABSORBER FOR MICE S. Ishimoto, S. Suzuki, M.

  4. Estimating Entropy of Liquids from Atom-Atom Radial Distribution Functions: Silica, Beryllium Fluoride and Water

    E-Print Network [OSTI]

    Ruchi Sharma; Manish Agarwal; Charusita Chakravarty

    2008-09-24T23:59:59.000Z

    Molecular dynamics simulations of water, liquid beryllium fluoride and silica melt are used to study the accuracy with which the entropy of ionic and molecular liquids can be estimated from atom-atom radial distribution function data. All three systems are known to display similar liquid-state thermodynamic and kinetic anomalies due to a region of anomalous excess entropy behaviour where entropy rises on isothermal compression. The pair correlation entropy is demonstrated to be sufficiently accurate that the density-temperature regime of anomalous behaviour as well as the strength of the entropy anomaly can be predicted reliably for both ionic melts as well as different rigid-body pair potentials for water. Errors in the total thermodynamic entropy for ionic melts due to the pair correlation approximation are of the order of 10% or less for most state points but can be significantly larger in the anomalous regime at very low temperatures. In the case of water, as expected given the rigid-body constraints for a molecular liquids, the pair correlation approximation causes significantly larger errors, between 20 and 30%, for most state points. Comparison of the excess entropy, Se, of ionic melts with the pair correlation entropy, S2, shows that the temperature dependence of Se is well described by T ??2=5 scaling across both the normal and anomalous regimes, unlike in the case of S2. As a function of density, the Se(rho) curves shows only a single maximum while the S2(rho) curves show both a maximum and a minimum. These differences in the behaviour of S2 and Se are due to the fact that the residual multiparticle entropy, delta(S) = Se - S2, shows a strong negative correlation with tetrahedral order in the anomalous regime.

  5. Non-Fickian ionic diffusion across high-concentration gradients

    SciTech Connect (OSTI)

    Carey, A.E.; Wheatcraft, S.W. [Univ. of Nevada, Reno, NV (United States)] [Univ. of Nevada, Reno, NV (United States); Glass, R.J. [Sandia National Laboratory, Albuquerque, NM (United States)] [and others] [Sandia National Laboratory, Albuquerque, NM (United States); and others

    1995-09-01T23:59:59.000Z

    A non-Fickian physico-chemical model for electrolyte transport in high-ionic strength systems is developed and tested with laboratory experiments with copper sulfate as an example electrolyte. The new model is based on irreversible thermodynamics and uses measured mutual diffusion coefficients, varying with concentration. Compared to a traditional Fickian model, the new model predicts less diffusion and asymmetric diffusion profiles. Laboratory experiments show diffusion rates even smaller than those predicted by our non-Fickian model, suggesting that there are additional, unaccounted for processes retarding diffusion. Ionic diffusion rates maybe a limiting factor in transporting salts whose effect on fluid density will in turn significantly affect the flow regime. These findings have important implications for understanding and predicting solute transport in geologic settings where dense, saline solutions occur. 30 refs., 5 figs.

  6. Mixed ionic and electronic conducting ceramic membranes for hydrocarbon processing

    SciTech Connect (OSTI)

    Van Calcar, Pamela (Superior, CO); Mackay, Richard (Lafayette, CO); Sammells, Anthony F. (Boulder, CO)

    2002-01-01T23:59:59.000Z

    The invention relates to mixed phase materials for the preparation of catalytic membranes which exhibit ionic and electronic conduction and which exhibit improved mechanical strength compared to single phase ionic and electronic conducting materials. The mixed phase materials are useful for forming gas impermeable membranes either as dense ceramic membranes or as dense thin films coated onto porous substrates. The membranes and materials of this invention are useful in catalytic membrane reactors in a variety of applications including synthesis gas production. One or more crystalline second phases are present in the mixed phase material at a level sufficient to enhance the mechanical strength of the mixture to provide membranes for practical application in CMRs.

  7. ESM of Ionic and Electrochemical Phenomena on the Nanoscale

    SciTech Connect (OSTI)

    Kalinin, Sergei V [ORNL; Kumar, Amit [Pennsylvania State University; Balke, Nina [ORNL; McCorkle, Morgan L [ORNL; Guo, Senli [ORNL; Arruda, Thomas M [ORNL; Jesse, Stephen [ORNL

    2011-01-01T23:59:59.000Z

    Operation of energy storage and conversion devices is ultimately controlled by series of intertwined ionic and electronic transport processes and electrochemical reactions at surfaces and interfaces, strongly mediated by strain and mechanical processes [1-4]. In a typical fuel cell, these include chemical species transport in porous cathode and anode materials, gas-solid electrochemical reactions at grains and triple-phase boundaries (TPBs), ionic and electronic flows in multicomponent electrodes, and chemical and electronic potential drops at internal interfaces in electrodes and electrolytes. All these phenomena are sensitively affected by the microstructure of materials from device level to the atomic scales as illustrated in Fig. 1. Similar spectrum of length scales and phenomena underpin operation of other energy systems including primary and secondary batteries, as well as hybrid systems such flow and metal-air/water batteries.

  8. Anomalous high ionic conductivity of nanoporous -Li3PS4

    SciTech Connect (OSTI)

    Liu, Zengcai [ORNL] [ORNL; Fu, Wujun [ORNL] [ORNL; Payzant, E Andrew [ORNL] [ORNL; Yu, Xiang [ORNL] [ORNL; Wu, Zili [ORNL] [ORNL; Dudney, Nancy J [ORNL] [ORNL; Kiggans, Jim [ORNL] [ORNL; Hong, Kunlun [ORNL] [ORNL; Rondinone, Adam Justin [ORNL; Liang, Chengdu [ORNL] [ORNL

    2013-01-01T23:59:59.000Z

    Lithium-ion conducting solid electrolytes hold the promise for enabling high-energy battery chemistries and circumventing safety issues of conventional lithium batteries1-3. Achieving the combination of high ionic conductivity and broad electrochemical window in solid electrolytes is a grand challenge for the synthesis of battery materials. Herein we show an enhancement of room-temperature lithium-ion conductivity of 3 orders of magnitude by creating nanostructured Li3PS4. This material has a wide (5V) electrochemical window and superior chemical stability against lithium metal. The nanoporous structure of Li3PS4 reconciles two vital effects that enhance ionic conductivity: (1) The reduced dimension to nanometer-sized framework stabilizes the high conduction beta phase that occurs at elevated temperatures1,4; and (2) The high surface-to-bulk ratio of nanoporous -Li3PS4 promotes surface conduction5,6. Manipulating the ionic conductivity of solid electrolytes has far-reaching implications for materials design and synthesis in a broad range of applications such as batteries, fuel-cells, sensors, photovoltaic systems, and so forth3,7.

  9. aerodyne aerosol mass: Topics by E-print Network

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    independent measurements of fine particle volume or particle-into-liquid sampler (PILS) ion chromatography measurements for 3 field campaigns with different dominant aerosol...

  10. Equation for liquid density

    SciTech Connect (OSTI)

    Yaws, C.L.; Yang, H.C.; Hopper, J.R.; Cawley, W.A. (Lamar Univ., Beaumont, TX (US))

    1991-01-01T23:59:59.000Z

    Saturated liquid densities for organic chemicals are given as functions of temperature using a modified Rackett equation.

  11. Liquid detection circuit

    DOE Patents [OSTI]

    Regan, Thomas O. (North Aurora, IL)

    1987-01-01T23:59:59.000Z

    Herein is a circuit which is capable of detecting the presence of liquids, especially cryogenic liquids, and whose sensor will not overheat in a vacuum. The circuit parameters, however, can be adjusted to work with any liquid over a wide range of temperatures.

  12. Thermodynamics and Ionic Conductivity of Block Copolymer Electrolytes

    E-Print Network [OSTI]

    Wanakule, Nisita Sidra

    2010-01-01T23:59:59.000Z

    B. and J. Garche, Lithium batteries: Status, prospects andionic liquids for lithium batteries. Journal of Powersolid-state rechargeable lithium batteries. Journal of the

  13. Radiation monitor for liquids

    DOE Patents [OSTI]

    Koster, J.E.; Bolton, R.D.

    1999-03-02T23:59:59.000Z

    A radiation monitor for use with liquids that utilizes air ions created by alpha radiation emitted by the liquids as its detectable element. A signal plane, held at an electrical potential with respect to ground, collects these air ions. A guard plane or guard rings is used to limit leakage currents. In one embodiment, the monitor is used for monitoring liquids retained in a tank. Other embodiments monitor liquids flowing through a tank, and bodies of liquids, such as ponds, lakes, rivers and oceans. 4 figs.

  14. Radiation monitor for liquids

    DOE Patents [OSTI]

    Koster, James E. (Los Alamos, NM); Bolton, Richard D. (Los Alamos, NM)

    1999-01-01T23:59:59.000Z

    A radiation monitor for use with liquids that utilizes air ions created by alpha radiation emitted by the liquids as its detectable element. A signal plane, held at an electrical potential with respect to ground, collects these air ions. A guard plane or guard rings is used to limit leakage currents. In one embodiment, the monitor is used for monitoring liquids retained in a tank. Other embodiments monitor liquids flowing through a tank, and bodies of liquids, such as ponds, lakes, rivers and oceans.

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

    DOE Patents [OSTI]

    Heldebrant, David J. (Richland, WA); Yonker, Clement R. (Kennewick, WA)

    2010-09-21T23:59:59.000Z

    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.

  16. Liquid Wall Chambers

    SciTech Connect (OSTI)

    Meier, W R

    2011-02-24T23:59:59.000Z

    The key feature of liquid wall chambers is the use of a renewable liquid layer to protect chamber structures from target emissions. Two primary options have been proposed and studied: wetted wall chambers and thick liquid wall (TLW) chambers. With wetted wall designs, a thin layer of liquid shields the structural first wall from short ranged target emissions (x-rays, ions and debris) but not neutrons. Various schemes have been proposed to establish and renew the liquid layer between shots including flow-guiding porous fabrics (e.g., Osiris, HIBALL), porous rigid structures (Prometheus) and thin film flows (KOYO). The thin liquid layer can be the tritium breeding material (e.g., flibe, PbLi, or Li) or another liquid metal such as Pb. TLWs use liquid jets injected by stationary or oscillating nozzles to form a neutronically thick layer (typically with an effective thickness of {approx}50 cm) of liquid between the target and first structural wall. In addition to absorbing short ranged emissions, the thick liquid layer degrades the neutron flux and energy reaching the first wall, typically by {approx}10 x x, so that steel walls can survive for the life of the plant ({approx}30-60 yrs). The thick liquid serves as the primary coolant and tritium breeding material (most recent designs use flibe, but the earliest concepts used Li). In essence, the TLW places the fusion blanket inside the first wall instead of behind the first wall.

  17. Liquid Metal Transformers

    E-Print Network [OSTI]

    Sheng, Lei; Liu, Jing

    2014-01-01T23:59:59.000Z

    The room temperature liquid metal is quickly emerging as an important functional material in a variety of areas like chip cooling, 3D printing or printed electronics etc. With diverse capabilities in electrical, thermal and flowing behaviors, such fluid owns many intriguing properties that had never been anticipated before. Here, we show a group of unconventional phenomena occurring on the liquid metal objects. Through applying electrical field on the liquid metals immersed in water, a series of complex transformation behaviors such as self-assembling of a sheet of liquid metal film into a single sphere, quick mergences of separate metal droplets, controlled self-rotation and planar locomotion of liquid metal objects can be realized. Meanwhile, it was also found that two accompanying water vortexes were induced and reliably swirled near the rotating liquid metal sphere. Further, effects of the shape, size, voltage, orientation and geometries of the electrodes to control the liquid metal transformers were clar...

  18. Selective Extraction of Uranium from Liquid or Supercritical Carbon Dioxide

    SciTech Connect (OSTI)

    Farawila, Anne F.; O'Hara, Matthew J.; Wai, Chien M.; Taylor, Harry Z.; Liao, Yu-Jung

    2012-07-31T23:59:59.000Z

    Current liquid-liquid extraction processes used in recycling irradiated nuclear fuel rely on (1) strong nitric acid to dissolve uranium oxide fuel, and (2) the use of aliphatic hydrocarbons as a diluent in formulating the solvent used to extract uranium. The nitric acid dissolution process is not selective. It dissolves virtually the entire fuel meat which complicates the uranium extraction process. In addition, a solvent washing process is used to remove TBP degradation products, which adds complexity to the recycling plant and increases the overall plant footprint and cost. A liquid or supercritical carbon dioxide (l/sc -CO2) system was designed to mitigate these problems. Indeed, TBP nitric acid complexes are highly soluble in l/sc -CO2 and are capable of extracting uranium directly from UO2, UO3 and U3O8 powders. This eliminates the need for total acid dissolution of the irradiated fuel. Furthermore, since CO2 is easily recycled by evaporation at room temperature and pressure, it eliminates the complex solvent washing process. In this report, we demonstrate: (1) A reprocessing scheme starting with the selective extraction of uranium from solid uranium oxides into a TBP-HNO3 loaded Sc-CO2 phase, (2) Back extraction of uranium into an aqueous phase, and (3) Conversion of recovered purified uranium into uranium oxide. The purified uranium product from step 3 can be disposed of as low level waste, or mixed with enriched uranium for use in a reactor for another fuel cycle. After an introduction on the concept and properties of supercritical fluids, we first report the characterization of the different oxides used for this project. Our extraction system and our online monitoring capability using UV-Vis absorbance spectroscopy directly in sc-CO2 is then presented. Next, the uranium extraction efficiencies and kinetics is demonstrated for different oxides and under different physical and chemical conditions: l/sc -CO2 pressure and temperature, TBP/HNO3 complex used, reductant or complexant used for selectivity, and ionic liquids used as supportive media. To complete the extraction and recovery cycle, we then demonstrate uranium back extraction from the TBP loaded sc-CO2 phase into an aqueous phase and the characterization of the uranium complex formed at the end of this process. Another aspect of this project was to limit proliferation risks by either co-extracting uranium and plutonium, or by leaving plutonium behind by selectively extracting uranium. We report that the former is easily achieved, since plutonium is in the tetravalent or hexavalent oxidation state in the oxidizing environment created by the TBP-nitric acid complex, and is therefore co-extracted. The latter is more challenging, as a reductant or complexant to plutonium has to be used to selectively extract uranium. After undertaking experiments on different reducing or complexing systems (e.g., AcetoHydroxamic Acid (AHA), Fe(II), ascorbic acid), oxalic acid was chosen as it can complex tetravalent actinides (Pu, Np, Th) in the aqueous phase while allowing the extraction of hexavalent uranium in the sc-CO2 phase. Finally, we show results using an alternative media to commonly used aqueous phases: ionic liquids. We show the dissolution of uranium in ionic liquids and its extraction using sc-CO2 with and without the presence of AHA. The possible separation of trivalent actinides from uranium is also demonstrated in ionic liquids using neodymium as a surrogate and diglycolamides as the extractant.

  19. Is thermo-ionic emission at room temperature exploitable?

    E-Print Network [OSTI]

    Germano D'Abramo

    2009-05-21T23:59:59.000Z

    In this brief note we describe two devices, a sort of flat and spherical capacitor, with which one should be able to test the possibility of creating a macroscopic voltage, and thus exploitable current, out of a single thermal source at room temperature. The basic idea is trivial and it makes use of a thermo-emitting cathode with work function as low as 0.7eV. The idea is not completely new, but our approach is simpler and neat. When implemented, it should allow to assess if approaches based on thermo-ionic materials at room temperature really violate the Second Law of Thermodynamics macroscopically.

  20. Liquid level detector

    DOE Patents [OSTI]

    Tshishiku, Eugene M. (Augusta, GA)

    2011-08-09T23:59:59.000Z

    A liquid level detector for conductive liquids for vertical installation in a tank, the detector having a probe positioned within a sheath and insulated therefrom by a seal so that the tip of the probe extends proximate to but not below the lower end of the sheath, the lower end terminating in a rim that is provided with notches, said lower end being tapered, the taper and notches preventing debris collection and bubble formation, said lower end when contacting liquid as it rises will form an airtight cavity defined by the liquid, the interior sheath wall, and the seal, the compression of air in the cavity preventing liquid from further entry into the sheath and contact with the seal. As a result, the liquid cannot deposit a film to form an electrical bridge across the seal.

  1. (Ionization in liquids)

    SciTech Connect (OSTI)

    Not Available

    1991-01-01T23:59:59.000Z

    This document describes charge transport following ionization of model liquids and how this process may be important in carcinogenesis. 15 refs., 2 figs., 4 tabs. (MHB)

  2. Ultrasonic liquid level detector

    DOE Patents [OSTI]

    Kotz, Dennis M. (North Augusta, SC); Hinz, William R. (Augusta, GA)

    2010-09-28T23:59:59.000Z

    An ultrasonic liquid level detector for use within a shielded container, the detector being tubular in shape with a chamber at its lower end into which liquid from in the container may enter and exit, the chamber having an ultrasonic transmitter and receiver in its top wall and a reflector plate or target as its bottom wall whereby when liquid fills the chamber a complete medium is then present through which an ultrasonic wave may be transmitted and reflected from the target thus signaling that the liquid is at chamber level.

  3. Liquid Metal Transformers

    E-Print Network [OSTI]

    Lei Sheng; Jie Zhang; Jing Liu

    2014-01-30T23:59:59.000Z

    The room temperature liquid metal is quickly emerging as an important functional material in a variety of areas like chip cooling, 3D printing or printed electronics etc. With diverse capabilities in electrical, thermal and flowing behaviors, such fluid owns many intriguing properties that had never been anticipated before. Here, we show a group of unconventional phenomena occurring on the liquid metal objects. Through applying electrical field on the liquid metals immersed in water, a series of complex transformation behaviors such as self-assembling of a sheet of liquid metal film into a single sphere, quick mergences of separate metal droplets, controlled self-rotation and planar locomotion of liquid metal objects can be realized. Meanwhile, it was also found that two accompanying water vortexes were induced and reliably swirled near the rotating liquid metal sphere. Further, effects of the shape, size, voltage, orientation and geometries of the electrodes to control the liquid metal transformers were clarified. Such events are hard to achieve otherwise on rigid metal or conventional liquid spheres. This finding has both fundamental and practical significances which suggest a generalized way of making smart soft machine, collecting discrete metal fluids, as well as flexibly manipulating liquid metal objects including accompanying devices.

  4. Liquid Crystal Optofluidics

    SciTech Connect (OSTI)

    Vasdekis, Andreas E.; Cuennet, J. G.; Psaltis, D.

    2012-10-11T23:59:59.000Z

    By employing anisotropic fluids and namely liquid crystals, fluid flow becomes an additional degree of freedom in designing optofluidic devices. In this paper, we demonstrate optofluidic liquid crystal devices based on the direct flow of nematic liquid crystals in microfluidic channels. Contrary to previous reports, in the present embodiment we employ the effective phase delay acquired by light travelling through flowing liquid crystal, without analysing the polarisation state of the transmitted light. With this method, we demonstrate the variation in the diffraction pattern of an array of microfluidic channels acting as a grating. We also discuss our recent activities in integrating mechanical oscillators for on-chip peristaltic pumping.

  5. Size distributions of ionic aerosols measured at Waliguan Observatory: Implication for nitrate gas-to-particle

    E-Print Network [OSTI]

    Jacobson, Mark

    Size distributions of ionic aerosols measured at Waliguan Observatory: Implication for nitrate gas Plateau. Size-resolved ionic aerosols (NH4 + , Na+ , K+ , Ca2+ , Mg2+ , SO4 2À , ClÀ , NO3 À CO3 2À , formate, acetate and oxalate), organic aerosols, black carbon and gaseous HNO3 and SO2 were measured

  6. Millisecond switching in solid state electrochromic polymer devices fabricated from ionic self-assembled multilayers

    E-Print Network [OSTI]

    Heflin, Randy

    Millisecond switching in solid state electrochromic polymer devices fabricated from ionic self The electrochromic switching times of solid state conducting polymer devices fabricated by the ionic self shown to decrease with the active area of the electrochromic device suggesting that even faster

  7. Probing Local Ionic Dynamics in Functional Oxides at the Nanoscale Evgheni Strelcov,*,

    E-Print Network [OSTI]

    Chen, Long-Qing

    electronic-ionic conductors, which underpins applications in energy conversion technologies, for example the development of novel data storage technologies. Notably, many TMOs classes including manganites,16 cobaltites, for example ionic transport, polarization-driven responses, and surface electro- chemistry.35,36 Recently, we

  8. Surface Tension of Electrolyte Interfaces: Ionic Specificity within a Field-Theory Approach

    E-Print Network [OSTI]

    Andelman, David

    Surface Tension of Electrolyte Interfaces: Ionic Specificity within a Field-Theory Approach Tomer, 1000 Ljubljana, Slovenia (Dated: November 19, 2014) We study the surface tension of ionic solutions expansion beyond the mean-field result. We calculate the excess surface tension and obtain analytical

  9. Scalability of mass transfer in liquid-liquid flow

    E-Print Network [OSTI]

    Woitalka, A.

    We address liquid–liquid mass transfer between immiscible liquids using the system 1-butanol and water, with succinic acid as the mass transfer component. Using this system we evaluate the influence of two-phase flow ...

  10. INEEL Liquid Effluent Inventory

    SciTech Connect (OSTI)

    Major, C.A.

    1997-06-01T23:59:59.000Z

    The INEEL contractors and their associated facilities are required to identify all liquid effluent discharges that may impact the environment at the INEEL. This liquid effluent information is then placed in the Liquid Effluent Inventory (LEI) database, which is maintained by the INEEL prime contractor. The purpose of the LEI is to identify and maintain a current listing of all liquid effluent discharge points and to identify which discharges are subject to federal, state, or local permitting or reporting requirements and DOE order requirements. Initial characterization, which represents most of the INEEL liquid effluents, has been performed, and additional characterization may be required in the future to meet regulations. LEI information is made available to persons responsible for or concerned with INEEL compliance with liquid effluent permitting or reporting requirements, such as the National Pollutant Discharge Elimination System, Wastewater Land Application, Storm Water Pollution Prevention, Spill Prevention Control and Countermeasures, and Industrial Wastewater Pretreatment. The State of Idaho Environmental Oversight and Monitoring Program also needs the information for tracking liquid effluent discharges at the INEEL. The information provides a baseline from which future liquid discharges can be identified, characterized, and regulated, if appropriate. The review covered new and removed buildings/structures, buildings/structures which most likely had new, relocated, or removed LEI discharge points, and at least 10% of the remaining discharge points.

  11. Liquid heat capacity lasers

    DOE Patents [OSTI]

    Comaskey, Brian J. (Walnut Creek, CA); Scheibner, Karl F. (Tracy, CA); Ault, Earl R. (Livermore, CA)

    2007-05-01T23:59:59.000Z

    The heat capacity laser concept is extended to systems in which the heat capacity lasing media is a liquid. The laser active liquid is circulated from a reservoir (where the bulk of the media and hence waste heat resides) through a channel so configured for both optical pumping of the media for gain and for light amplification from the resulting gain.

  12. Low velocity ion stopping in binary ionic mixtures

    SciTech Connect (OSTI)

    Tashev, Bekbolat; Baimbetov, Fazylkhan [Department of Physics, Kazakh National University, Tole Bi 96, Almaty 480012 (Kazakhstan); Deutsch, Claude [LPGP (UMR-CNRS 8578), Universite Paris XI, 91405 Orsay (France); Fromy, Patrice [Direction de l'Informatique, Universite Paris XI, 91405 Orsay (France)

    2008-10-15T23:59:59.000Z

    Attention is focused on the low ion velocity stopping mechanisms in multicomponent and dense target plasmas built of quasiclassical electron fluids neutralizing binary ionic mixtures, such as, deuterium-tritium of current fusion interest, proton-heliumlike iron in the solar interior or proton-helium ions considered in planetology, as well as other mixtures of fiducial concern in the heavy ion beam production of warm dense matter at Bragg peak conditions. The target plasma is taken in a multicomponent dielectric formulation a la Fried-Conte. The occurrence of projectile ion velocities (so-called critical) for which target electron slowing down equals that of given target ion components is also considered. The corresponding multiquadrature computations, albeit rather heavy, can be monitored analytical through a very compact code operating a PC cluster. Slowing down results are systematically scanned with respect to target temperature and electron density, as well as ion composition.

  13. Multiphysics simulation of corona discharge induced ionic wind

    SciTech Connect (OSTI)

    Cagnoni, Davide [ABB Switzerland Ltd., Corporate Research, CH-5405 Baden-Dättwil (Switzerland) [ABB Switzerland Ltd., Corporate Research, CH-5405 Baden-Dättwil (Switzerland); MOX - Dipartimento di Matematica “F. Brioschi,” Politecnico di Milano, 20133 Milano (Italy); Agostini, Francesco; Christen, Thomas [ABB Switzerland Ltd., Corporate Research, CH-5405 Baden-Dättwil (Switzerland)] [ABB Switzerland Ltd., Corporate Research, CH-5405 Baden-Dättwil (Switzerland); Parolini, Nicola [MOX - Dipartimento di Matematica “F. Brioschi,” Politecnico di Milano, 20133 Milano (Italy)] [MOX - Dipartimento di Matematica “F. Brioschi,” Politecnico di Milano, 20133 Milano (Italy); Stevanovi?, Ivica [ABB Switzerland Ltd., Corporate Research, CH-5405 Baden-Dättwil (Switzerland) [ABB Switzerland Ltd., Corporate Research, CH-5405 Baden-Dättwil (Switzerland); Laboratory of Electromagnetics and Acoustics, Ecole Polytechnique Fédérale de Lausanne, CH-1015 Lausanne (Switzerland); Falco, Carlo de [MOX - Dipartimento di Matematica “F. Brioschi,” Politecnico di Milano, 20133 Milano (Italy) [MOX - Dipartimento di Matematica “F. Brioschi,” Politecnico di Milano, 20133 Milano (Italy); CEN - Centro Europeo di Nanomedicina, 20133 Milano (Italy)

    2013-12-21T23:59:59.000Z

    Ionic wind devices or electrostatic fluid accelerators are becoming of increasing interest as tools for thermal management, in particular for semiconductor devices. In this work, we present a numerical model for predicting the performance of such devices; its main benefit is the ability to accurately predict the amount of charge injected from the corona electrode. Our multiphysics numerical model consists of a highly nonlinear, strongly coupled set of partial differential equations including the Navier-Stokes equations for fluid flow, Poisson's equation for electrostatic potential, charge continuity, and heat transfer equations. To solve this system we employ a staggered solution algorithm that generalizes Gummel's algorithm for charge transport in semiconductors. Predictions of our simulations are verified and validated by comparison with experimental measurements of integral physical quantities, which are shown to closely match.

  14. Liquid sampling system

    DOE Patents [OSTI]

    Larson, L.L.

    1984-09-17T23:59:59.000Z

    A conduit extends from a reservoir through a sampling station and back to the reservoir in a closed loop. A jet ejector in the conduit establishes suction for withdrawing liquid from the reservoir. The conduit has a self-healing septum therein upstream of the jet ejector for receiving one end of a double-ended cannula, the other end of which is received in a serum bottle for sample collection. Gas is introduced into the conduit at a gas bleed between the sample collection bottle and the reservoir. The jet ejector evacuates gas from the conduit and the bottle and aspirates a column of liquid from the reservoir at a high rate. When the withdrawn liquid reaches the jet ejector the rate of flow therethrough reduces substantially and the gas bleed increases the pressure in the conduit for driving liquid into the sample bottle, the gas bleed forming a column of gas behind the withdrawn liquid column and interrupting the withdrawal of liquid from the reservoir. In the case of hazardous and toxic liquids, the sample bottle and the jet ejector may be isolated from the reservoir and may be further isolated from a control station containing remote manipulation means for the sample bottle and control valves for the jet ejector and gas bleed. 5 figs.

  15. Liquid sampling system

    DOE Patents [OSTI]

    Larson, Loren L. (Idaho Falls, ID)

    1987-01-01T23:59:59.000Z

    A conduit extends from a reservoir through a sampling station and back to the reservoir in a closed loop. A jet ejector in the conduit establishes suction for withdrawing liquid from the reservoir. The conduit has a self-healing septum therein upstream of the jet ejector for receiving one end of a double-ended cannula, the other end of which is received in a serum bottle for sample collection. Gas is introduced into the conduit at a gas bleed between the sample collection bottle and the reservoir. The jet ejector evacuates gas from the conduit and the bottle and aspirates a column of liquid from the reservoir at a high rate. When the withdrawn liquid reaches the jet ejector the rate of flow therethrough reduces substantially and the gas bleed increases the pressure in the conduit for driving liquid into the sample bottle, the gas bleed forming a column of gas behind the withdrawn liquid column and interrupting the withdrawal of liquid from the reservoir. In the case of hazardous and toxic liquids, the sample bottle and the jet ejector may be isolated from the reservoir and may be further isolated from a control station containing remote manipulation means for the sample bottle and control valves for the jet ejector and gas bleed.

  16. Electrically Deformable Liquid Marbles

    E-Print Network [OSTI]

    Edward Bormashenko; Roman Pogreb; Tamir Stein; Gene Whyman; Marcelo Schiffer; Doron Aurbach

    2011-02-17T23:59:59.000Z

    Liquid marbles, which are droplets coated with a hydrophobic powder, were exposed to a uniform electric field. It was established that a threshold value of the electric field, 15 cgse, should be surmounted for deformation of liquid marbles. The shape of the marbles was described as a prolate spheroid. The semi-quantitative theory describing deformation of liquid marbles in a uniform electric field is presented. The scaling law relating the radius of the contact area of the marble to the applied electric field shows a satisfactory agreement with the experimental data.

  17. Liquid metal electric pump

    DOE Patents [OSTI]

    Abbin, J.P.; Andraka, C.E.; Lukens, L.L.; Moreno, J.B.

    1992-01-14T23:59:59.000Z

    An electrical pump for pumping liquid metals to high pressures in high temperature environments without the use of magnets or moving mechanical parts. The pump employs a non-porous solid electrolyte membrane, typically ceramic, specific to the liquid metal to be pumped. A DC voltage is applied across the thickness of the membrane causing ions to form and enter the membrane on the electrically positive surface, with the ions being neutralized on the opposite surface. This action provides pumping of the liquid metal from one side of the non-porous solid electrolyte membrane to the other. 3 figs.

  18. Liquid metal electric pump

    DOE Patents [OSTI]

    Abbin, Joseph P. (Albuquerque, NM); Andraka, Charles E. (Albuquerque, NM); Lukens, Laurance L. (Albuquerque, NM); Moreno, James B. (Albuquerque, NM)

    1992-01-01T23:59:59.000Z

    An electrical pump for pumping liquid metals to high pressures in high temperature environments without the use of magnets or moving mechanical parts. The pump employs a non-porous solid electrolyte membrane, typically ceramic, specific to the liquid metal to be pumped. A DC voltage is applied across the thickness of the membrane causing ions to form and enter the membrane on the electrically positive surface, with the ions being neutralized on the opposite surface. This action provides pumping of the liquid metal from one side of the non-porous solid electrolyte membrane to the other.

  19. Decoupling Ionic Conductivity from Structural Relaxation: A Way to Solid Polymer Electrolytes?

    SciTech Connect (OSTI)

    Agapov, Alexander L [ORNL; Sokolov, Alexei P [ORNL

    2011-01-01T23:59:59.000Z

    Using broadband dielectric spectroscopy, we studied the temperature dependence of ionic conductivity and structural relaxation in a number of polymers. We demonstrate that temperature dependence of ionic conductivity can be decoupled from structural relaxation in a material specific way. We show that the strength of the decoupling correlates with the steepness of the temperature dependence of structural relaxation in the polymer, i.e., with its fragility. We ascribe the observed result to stronger frustration in chain packing characteristic for more fragile polymers. We speculate that employment of more fragile polymers might lead to design of polymers with higher ionic conductivity.

  20. Liquid crystal-enabled electroosmosis through spatial charge separation in distorted regions as a novel mechanism of electrokinetics

    E-Print Network [OSTI]

    Israel Lazo; Chenhui Peng; Jie Xiang; Sergij V. Shiyanovskii; Oleg D. Lavrentovich

    2014-08-11T23:59:59.000Z

    Electrically-controlled dynamics of fluids and particles at microscales is a fascinating area of research with applications ranging from microfluidics and sensing to sorting of biomolecules. The driving mechanisms are electric forces acting on spatially separated charges in an isotropic medium such as water. Here we demonstrate that anisotropic conductivity of liquid crystals enables new mechanism of highly efficient electro-osmosis rooted in space charging of regions with distorted orientation. The electric field acts on these distortion-separated charges to induce liquid crystal-enabled electro-osmosis (LCEO). LCEO velocities grow with the square of the field, which allows one to use an AC field to drive steady flows and to avoid electrode damage. Ionic currents in liquid crystals that have been traditionally considered as an undesirable feature in displays, offer a broad platform for versatile applications such as liquid crystal enabled electrokinetics, micropumping and mixing.

  1. Liquid Phase Heating Systems

    E-Print Network [OSTI]

    Mordt, E. H.

    1979-01-01T23:59:59.000Z

    Temperature Water (HTW) central district heating systems are far superior to steam systems in large, spread out installations such as airports, universities and office complexes. Water, pressurized to keep it in the liquid state, is distributed at 400o...

  2. Liquidity facilities and signaling

    E-Print Network [OSTI]

    Arregui, Nicolás

    2010-01-01T23:59:59.000Z

    This dissertation studies the role of signaling concerns in discouraging access to liquidity facilities like the IMF contingent credit lines (CCL) and the Discount Window (DW). In Chapter 1, I analyze the introduction of ...

  3. Liquid crystalline composites containing phyllosilicates

    DOE Patents [OSTI]

    Chaiko, David J.

    2004-07-13T23:59:59.000Z

    The present invention provides phyllosilicate-polymer compositions which are useful as liquid crystalline composites. Phyllosilicate-polymer liquid crystalline compositions of the present invention can contain a high percentage of phyllosilicate while at the same time be transparent. Because of the ordering of the particles liquid crystalline composite, liquid crystalline composites are particularly useful as barriers to gas transport.

  4. Liquid mixing device

    SciTech Connect (OSTI)

    O'Leary, R. P.

    1985-08-06T23:59:59.000Z

    A mixing device for mixing at least two liquids to produce a homogenous mixture. The device includes an elongated chamber in which a vertically oriented elongated mixing cavity is located. The cavity is sealed at its lower end and it is open at its upper end and in communication with the interior of the chamber. An elongated conduit extends the length of the cavity and is adapted to receive liquids to be mixed. The conduit includes a plurality of ports located at longitudinally spaced positions therealong and which ports are directed in different directions. The ports create plural streams of liquid which interact and mix with one another within the cavity. The mixed liquids overflow the cavity and out its top end into the chamber 24. The chamber 24 includes an outlet from which the mixed liquids are withdrawn. In accordance with the preferred embodiment gas eductor means are provided in the inlet to the conduit to introduce gas bubbles within the cavity. Gas vent means are also provided in the device to vent any introduced gases from the device so that only the mixed liquids flow out the outlet.

  5. Ionic Polymer-Metal Composites: Thermodynamical Modeling and Finite Element Solution 

    E-Print Network [OSTI]

    Arumugam, Jayavel

    2012-10-19T23:59:59.000Z

    This thesis deals with developing a thermodynamically consistent model to simulate the electromechanical response of ionic polymer-metal composites based on Euler-Bernoulli beam theory. Constitutive assumptions are made for the Helmholtz free...

  6. Ab-initio Kinetic Monte Carlo Model of Ionic Conduction in Bulk Yttria-stabilized Zirconia

    E-Print Network [OSTI]

    Cai, Wei

    oxide fuel cell (SOFC) and oxygen sensor, and hence has been extensively studied. In particular, the necessity of reducing the operating temperature of SOFC without losing ionic conductivity encourages

  7. Free-standing graphene membranes on glass nanopores for ionic current measurements

    E-Print Network [OSTI]

    Walker, Michael I.; Weatherup, Robert S.; Bell, Nicholas A. W.; Hofmann, Stephan; Keyser, Ulrich F.

    2015-01-16T23:59:59.000Z

    A method is established to reliably suspend graphene monolayers across glass nanopores as a simple, low cost platform to study ionic transport through graphene membranes. We systematically show that the graphene seals glass nanopore openings...

  8. Correlating Humidity-Dependent Ionically Conductive Surface Area with Transport Phenomena in Proton-Exchange Membranes

    SciTech Connect (OSTI)

    He, Qinggang; Kusoglu, Ahmet; Lucas, Ivan T.; Clark, Kyle; Weber, Adam Z.; Kostecki, Robert

    2011-08-01T23:59:59.000Z

    The objective of this effort was to correlate the local surface ionic conductance of a Nafion? 212 proton-exchange membrane with its bulk and interfacial transport properties as a function of water content. Both macroscopic and microscopic proton conductivities were investigated at different relative humidity levels, using electrochemical impedance spectroscopy and current-sensing atomic force microscopy (CSAFM). We were able to identify small ion-conducting domains that grew with humidity at the surface of the membrane. Numerical analysis of the surface ionic conductance images recorded at various relative humidity levels helped determine the fractional area of ion-conducting active sites. A simple square-root relationship between the fractional conducting area and observed interfacial mass-transport resistance was established. Furthermore, the relationship between the bulk ionic conductivity and surface ionic conductance pattern of the Nafion? membrane was examined.

  9. Influence of Ionic strength on calcium carbonate (CaCO3) polymorphism

    E-Print Network [OSTI]

    Evans, Taylor

    2012-01-01T23:59:59.000Z

    CaCO3 crystals' physical properties, such as polymorphism and hence the reflectivity and stability, are critical factors of their qualities in industrial applications. Factors such as additives and substrates that influence CaCO3 polymorphism have been intensively studied. However, the effects of ionic strength created by varying additives are seldom paid attention to. This study is analyzing how ionic strength of the growth solution influences the crystalline structure of CaCO3, by applying growth solutions containing different types of cations of varying concentrations, K+, Na+, and NH4+. This study reveals that the ionic strength plays a significant role in polymorph selection in the way that the percentage of vaterite among the precipitates increases with the concentration of ionic strength.

  10. Mixed ionic and electronic conducting electrode studies for an alkali metal thermal to electric converter

    E-Print Network [OSTI]

    Guo, Yuyan

    2009-05-15T23:59:59.000Z

    This research focuses on preparation, kinetics, and performance studies of mixed ionic and electronic conducting electrodes (MIEE) applied in an alkali metal thermal to electric converter (AMTEC). Two types of MIEE, metal/sodium titanate and metal...

  11. Design and Implementation of an Ionic-Polymer-Metal-Composite Biomimetic Robot

    E-Print Network [OSTI]

    Chang, Yi-Chu

    2013-05-02T23:59:59.000Z

    Ionic polymer metal composite (IPMC) is used in various bio-inspired systems, such as fish and tadpole-like robots swimming in water. The deflection of this smart material results from several internal and external factors, such as water...

  12. Nanopatterned Protein Films Directed by Ionic Complexation with Water-Soluble Diblock Copolymers

    E-Print Network [OSTI]

    Kim, Bokyung

    The use of ionic interactions to direct both protein templating and block copolymer self-assembly into nanopatterned films with only aqueous processing conditions is demonstrated using block copolymers containing both ...

  13. Laser wavelength effects on ionic and atomic emission from tin plasmas D. Campos,a

    E-Print Network [OSTI]

    Harilal, S. S.

    Laser wavelength effects on ionic and atomic emission from tin plasmas D. Campos,a S. S. Harilal centered at 13.5 nm. Spitzer et al.1 reported that tin targets irradiated by a neodymium-doped yttrium alu

  14. Superior Conductive Solid-like Electrolytes: Nanoconfining Liquids within the Hollow Structures

    SciTech Connect (OSTI)

    Zhang, Jinshui [ORNL; Bai, Ying [ORNL; Sun, Xiao-Guang [ORNL; Li, Yunchao [ORNL; Guo, Bingkun [ORNL; Chen, Jihua [ORNL; Veith, Gabriel M [ORNL; Hensley, Dale K [ORNL; Paranthaman, Mariappan Parans [ORNL; Goodenough, John B [University of Texas at Austin; Dai, Sheng [ORNL

    2015-01-01T23:59:59.000Z

    The growth and proliferation of lithium (Li) dendrites during cell recharge is unavoidable, which seriously hinders the development and application of rechargeable Li metal batteries. Solid electrolytes with robust mechanical modulus are regarded as a promising approach to overcome the dendrite problems. However, their room-temperature ionic conductivities are usually too low to reach the level required for normal battery operation. Here, a class of novel solid electrolytes with liquid-like room-temperature ionic conductivities (> 1 mS cm-1) has been successfully synthesized by taking advantage of the unique nanoarchitectures of hollow silica (HS) spheres to confine liquid electrolytes in hollow space to afford high conductivities. In a symmetric lithium/lithium cell, such kind of solid-like electrolytes demonstrates a robust performance against Li dendrite problems, well stabilizing the cell system from short circuiting in a long-time operation at current densities ranging from 0.16 to 0.32 mA cm-2. Moreover, the high flexibility and compatibility of HS nanoarchitectures, in principle, enables broad tunability to choose desired liquids for the fabrication of other kinds of solid-like electrolytes, such as those containing Na+, Mg2+ or Al3+ as conductive media, providing a useful alternative strategy for the development of next generation rechargeable batteries.

  15. Ionic strength independence of charge distributions in solvation of biomolecules

    SciTech Connect (OSTI)

    Virtanen, J. J. [Department of Chemistry, University of Chicago, Chicago, Illinois 60637 (United States); James Franck Institute, University of Chicago, Chicago, Illinois 60637 (United States); Sosnick, T. R. [Department of Biochemistry and Molecular Biology, Institute for Biophysical Dynamics, University of Chicago, Chicago, Illinois 60637 (United States); Computation Institute, University of Chicago, Chicago, Illinois 60637 (United States); Freed, K. F. [Department of Chemistry, University of Chicago, Chicago, Illinois 60637 (United States); James Franck Institute, University of Chicago, Chicago, Illinois 60637 (United States); Computation Institute, University of Chicago, Chicago, Illinois 60637 (United States)

    2014-12-14T23:59:59.000Z

    Electrostatic forces enormously impact the structure, interactions, and function of biomolecules. We perform all-atom molecular dynamics simulations for 5 proteins and 5 RNAs to determine the dependence on ionic strength of the ion and water charge distributions surrounding the biomolecules, as well as the contributions of ions to the electrostatic free energy of interaction between the biomolecule and the surrounding salt solution (for a total of 40 different biomolecule/solvent combinations). Although water provides the dominant contribution to the charge density distribution and to the electrostatic potential even in 1M NaCl solutions, the contributions of water molecules and of ions to the total electrostatic interaction free energy with the solvated biomolecule are comparable. The electrostatic biomolecule/solvent interaction energies and the total charge distribution exhibit a remarkable insensitivity to salt concentrations over a huge range of salt concentrations (20 mM to 1M NaCl). The electrostatic potentials near the biomolecule's surface obtained from the MD simulations differ markedly, as expected, from the potentials predicted by continuum dielectric models, even though the total electrostatic interaction free energies are within 11% of each other.

  16. Increasing Sugar Yields with IL-final-sm

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Ionic Liquid Processing Increasing sugar yields from diverse biomass feedstock with ionic liquid processing and cultivation of renewable ionic liquids Liberating Sugars from...

  17. liquid nberwp.tex Liquidity Constraints and Precautionary Saving

    E-Print Network [OSTI]

    Niebur, Ernst

    liquid nberwp.tex Liquidity Constraints and Precautionary Saving Christopher D. Carroll ccarroll to the optimal consumption/saving problem under uncertainty have long known that there are quantitatively important in- teractions between liquidity constraints and precautionary saving behavior. This paper

  18. Airborne measurement of inorganic ionic components of fine aerosol particles using the particle-into-liquid sampler coupled to ion

    E-Print Network [OSTI]

    . In addition to a sea-salt origin, ClÃ? showed a source in urban emissions possibly related to biofuel and that NH3 and other alkaline materials were in sufficient supply to neutralize H2SO4. The [NH4 + ] to ([NO3 and health effects, knowledge of the various types of aerosol sources from different regions of the world

  19. Long Term Thermal Stability In Air Of Ionic Liquid Based Alternative Heat Transfer Fluids For Clean Energy Production

    SciTech Connect (OSTI)

    Fox, Elise B; Kendrick, Sarah E.; Visser, Ann E.; Bridges, Nicholas J.

    2012-10-15T23:59:59.000Z

    The purpose of this study was to investigate the effect of long-term aging on the thermal stability and chemical structure of seven different ILs so as to explore their suitability for use as a heat transfer fluid. This was accomplished by heating the ILs for 15 weeks at 200?C in an oxidizing environment and performing subsequent analyses on the aged chemicals.

  20. Targeting adequate thermal stability and fire safety in selecting ionic liquid-based electrolytes for energy storage

    E-Print Network [OSTI]

    Paris-Sud XI, Université de

    for energy storage L. Chancelier,a,b A.O. Diallo,c,d C.C. Santini,*a G. Marlair,*c T. Gutel,b S. Mailley,b C Abstract The energy storage market relating to lithium based systems regularly grows in size and expands for the promotion of a new generation of energy storage systems. These systems must be capable of addressing

  1. Superoxide Electrochemistry in an Ionic Liquid Inas M. AlNashef, Matthew L. Leonard, Michael A. Matthews,* and

    E-Print Network [OSTI]

    Weidner, John W.

    -temperature molten salt systems.21 Os- teryoung et al.22 showed that superoxide ion could be generated

  2. Determination of Thermal Diffusivities, Thermal Conductivities, and Sound Speeds of Room-Temperature Ionic Liquids by the Transient Grating Technique

    E-Print Network [OSTI]

    Reid, Scott A.

    Determination of Thermal Diffusivities, Thermal Conductivities, and Sound Speeds of Room. The experiments give thermal diffusivities from which thermal conductivities can be determined, sound speeds not only on the sound speed but also on the thermal diffusivity and acoustic damping of the RTILs

  3. HOMOGENEOUS CATALYSIS AND MASS TRANSFER IN BIPHASIC IONIC LIQUID SYSTEMS WITH COMPRESSED CO2 AND ORGANIC COMPOUNDS

    E-Print Network [OSTI]

    Ahosseini, Azita

    ABSTRACT Homogeneous catalysis in which the catalyst, solvents and reactants are all in the same phase can yield high activity and selectivity and efficiently produce chemical products. However, the main problem with these ...

  4. Auto Template Assembly of CaCO3-Chitosan Hybrid Nanoboxes and Nanoframes in Ionic Liquid Medium 

    E-Print Network [OSTI]

    Chen, Hsingming Anna

    2012-07-16T23:59:59.000Z

    Recently, there has been increased effort in researching methods for producing hollow nanostructures because of their potential impact in the fields of catalysis, separation processes, drug delivery, and energy storage and conversion devices...

  5. Synthesis and physico-chemical properties of ionic liquids containing tetrakis(perfluorophenyl)borate, tetraphenylborate and trifluorophenylborate anions.

    E-Print Network [OSTI]

    Papaiconomou, Nicolas; Salminen, Justin; Yakelis, Neal; Prausnitz, John M.

    2006-01-01T23:59:59.000Z

    Scientific, used as received, in 150 mL of acetonitrile.and removal of the acetonitrile by rotary evaporation, theas received, in 150 mL of acetonitrile. After filtering and

  6. Properties of Liquid Plutonium

    SciTech Connect (OSTI)

    Freibert, Franz J. [Los Alamos National Laboratory; Mitchell, Jeremy N. [Los Alamos National Laboratory; Schwartz, Daniel S. [Los Alamos National Laboratory; Saleh, Tarik A. [Los Alamos National Laboratory; Migliori, Albert [Los Alamos National Laboratory

    2012-08-02T23:59:59.000Z

    Unalloyed polycrystalline Pu displays extreme thermal expansion behavior, i.e., {alpha} {yields} {beta} {yields} {gamma} {yields} {delta} increases by 25% in volume and {delta} {yields} {var_epsilon} {yields} liquid decreases by 4.5% in volume. Thus, making it difficult to measure density into the liquid state. Dilatometer outfitted with CaF molten metal cell offers a proven capability to measure thermal expansion in molten metals, but has yet to be proven for Pu. Historic data from the liquid nuclear fuels program will prove extremely useful as a guide to future measurements. 3.3at% Ga changes Pu molten metal properties: 50% increase in viscosity and {approx}3% decrease in density. Fe may decrease the density by a small amount assuming an averaging of densities for Pu-Ga and Pu-Fe liquids. More recent Boivineau (2009) work needs some interpretation, but technique is being employed in (U,Pu)O{sub 2} nuclear fuels program (Pu Futures, 2012).

  7. Breakup of Liquid Filaments

    E-Print Network [OSTI]

    Castrejon-Pita, Alfonso A.; Castrejon-Pita, J.R.; Hutchings, I.M.

    2012-01-01T23:59:59.000Z

    , including the dispersion of liquid drugs into res- pirable droplets, microfluidics, crop- and paint-spraying, and ink-jet printing [2–4]. There are also biological sys- tems in which either long filaments remain intact, or many droplets are formed [5, 6...

  8. Imaging Liquids Using Microfluidic Cells

    SciTech Connect (OSTI)

    Yu, Xiao-Ying; Liu, Bingwen; Yang, Li

    2013-05-10T23:59:59.000Z

    Chemistry occurring in the liquid and liquid surface is important in many applications. Chemical imaging of liquids using vacuum based analytical techniques is challenging due to the difficulty in working with liquids with high volatility. Recent development in microfluidics enabled and increased our capabilities to study liquid in situ using surface sensitive techniques such as electron microscopy and spectroscopy. Due to its small size, low cost, and flexibility in design, liquid cells based on microfluidics have been increasingly used in studying and imaging complex phenomena involving liquids. This paper presents a review of microfluidic cells that were developed to adapt to electron microscopes and various spectrometers for in situ chemical analysis and imaging of liquids. The following topics will be covered including cell designs, fabrication techniques, unique technical features for vacuum compatible cells, and imaging with electron microscopy and spectroscopy. Challenges are summarized and recommendations for future development priority are proposed.

  9. Liquid crystalline composites containing phyllosilicates

    DOE Patents [OSTI]

    Chaiko; David J. (Naperville, IL)

    2007-05-08T23:59:59.000Z

    The present invention provides barrier films having reduced gas permeability for use in packaging and coating applications. The barrier films comprise an anisotropic liquid crystalline composite layer formed from phyllosilicate-polymer compositions. Phyllosilicate-polymer liquid crystalline compositions of the present invention can contain a high percentage of phyllosilicate while remaining transparent. Because of the ordering of the particles in the liquid crystalline composite, barrier films comprising liquid crystalline composites are particularly useful as barriers to gas transport.

  10. Lubrication Behavior of Biolubricants and Antiwear Performance of Ionic

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    AFDC Printable Version Share this resource Send a link to EERE: Alternative Fuels Data Center Home Page to someone by E-mail Share EERE: Alternative Fuels Data Center Home Page on Facebook Tweet about EERE: Alternative Fuels Data Center Home Page on Twitter Bookmark EERE: Alternative1 First Use of Energy for All Purposes (Fuel and Nonfuel), 2002; Level: National5Sales for4,645U.S. DOE Office of Science (SC)Integrated Codes |IsLove Your Home and It'll Love You Back Love Your PrincipalLiquids

  11. Surface Tension of Electrolyte Interfaces: Ionic Specificity within a Field-Theory Approach

    E-Print Network [OSTI]

    Markovich, Tomer; Podgornik, Rudolf

    2014-01-01T23:59:59.000Z

    We study the surface tension of ionic solutions at air/water and oil/water interfaces. By using field-theoretical methods and including a finite proximal surface-region with ionic-specific interactions. The free energy is expanded to first-order in a loop expansion beyond the mean-field result. We calculate the excess surface tension and obtain analytical predictions that reunite the Onsager-Samaras pioneering result (which does not agree with experimental data), with the ionic specificity of the Hofmeister series. We derive analytically the surface-tension dependence on the ionic strength, ionic size and ion-surface interaction, and show consequently that the Onsager-Samaras result is consistent with the one-loop correction beyond the mean-field result. Our theory fits well a wide range of salt concentrations for different monovalent ions using one fit parameter, and reproduces the reverse Hofmeister series for anions at the air/water and oil/water interfaces.

  12. High temperature liquid level sensor

    DOE Patents [OSTI]

    Tokarz, Richard D. (West Richland, WA)

    1983-01-01T23:59:59.000Z

    A length of metal sheathed metal oxide cable is perforated to permit liquid access to the insulation about a pair of conductors spaced close to one another. Changes in resistance across the conductors will be a function of liquid level, since the wetted insulation will have greater electrical conductivity than that of the dry insulation above the liquid elevation.

  13. TTA solvation kinetics in the ionic liquid BumimTf2N Cintique de solvatation de la TTA dans le liquide ionique

    E-Print Network [OSTI]

    Boyer, Edmond

    "green" solvents in all fields of chemistry, in replacement of those traditional organic phases for which

  14. Soret motion in non-ionic binary molecular mixtures Yves Leroyer and Alois Wrger

    E-Print Network [OSTI]

    Boyer, Edmond

    on standard transport theory for liquids, we derive explicit expressions for the thermophoretic mobility

  15. Factors influencing quantitative liquid (scanning) transmission...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    Factors influencing quantitative liquid (scanning) transmission electron microscopy. Factors influencing quantitative liquid (scanning) transmission electron microscopy. Abstract:...

  16. Analysis & Simulation of Dynamics in Supercooled Liquids

    E-Print Network [OSTI]

    Elmatad, Yael Sarah

    2011-01-01T23:59:59.000Z

    Moreover, the heat capacity of that liquid is also higherthe intensive heat capacities of the liquid and the crystal,

  17. Help cut pollution with vapor/liquid and liquid/liquid separators

    SciTech Connect (OSTI)

    Woinsky, S.G.

    1994-10-01T23:59:59.000Z

    Vapor/liquid and liquid/liquid separators are common in chemical process industries plants. In addition to separating phases, these devices can aid in reducing pollution in the plant. Two-phase separators achieve pollution prevention via recycling of intermediates and final products. It is doubtful that most vapor/liquid and liquid/liquid separators are used specifically for pollution prevention projects. They may have another purpose yet provide pollution prevention as a bonus. The first step in achieving pollution prevention by design is for operating companies to be aware of vapor/liquid and liquid/liquid separators as potential pollution prevention devices. Then, likely applications need to be investigated. Since the quantities of material recovered are relatively small, higher value products are the most likely targets, especially for liquid/liquid separators. However, for vapor/liquid separators, the costs involved are usually relatively low since only the cost of a separator pad is normally involved, and more moderately valued products can be targets.

  18. Temperature Dependent Interaction Non-Additivity in the Inorganic Ionic Clusters

    E-Print Network [OSTI]

    Chaban, Vitaly V

    2015-01-01T23:59:59.000Z

    Interaction non-additivity in the chemical context means that binding of certain atom to a reference atom cannot be fully predicted from the interactions of these two atoms with other atoms. This constitutes one of key phenomena determining an identity of our world, which would have been much poorer otherwise. Ionic systems provide a good example of the interaction non-additivity in most cases due to electron transfer and delocalization effects. We report Born-Oppenheimer molecular dynamics (BOMD) simulations of LiCl, NaCl, and KCl at 300, 1500, and 2000 K. We show that our observations originate from interplay of thermal motion during BOMD and cation nature. In the case of alkali cations, ionic nature plays a more significant role than temperature. Our results bring fundamental understanding of electronic effects in the condensed phase of ionic systems and foster progress in physical chemistry and engineering.

  19. Liquid filtration simulation

    SciTech Connect (OSTI)

    Corey, I.; Bergman, W.

    1996-06-01T23:59:59.000Z

    We have a developed a computer code that simulates 3-D filtration of suspended particles in fluids in realistic filter structures. This code, being the most advanced filtration simulation package developed to date, provides LLNL and DOE with new capabilities to address problems in cleaning liquid wastes, medical fluid cleaning, and recycling liquids. The code is an integrated system of commercially available and LLNL-developed software; the most critical are the computational fluid dynamics (CFD) solver and the particle transport program. For the CFD solver, we used a commercial package based on Navier-Stokes equations and a LLNL-developed package based on Boltzman-lattice gas equations. For the particle transport program, we developed a cod based on the 3-D Langevin equation of motion and the DLVO theory of electrical interactions. A number of additional supporting packages were purchased or developed to integrate the simulation tasks and to provide visualization output.

  20. Schrodinger Fermi Liquids

    E-Print Network [OSTI]

    Wang, Juven

    2013-01-01T23:59:59.000Z

    We study a class of strongly interacting many-body fermionic systems in 2+1D non-relativistic conformal field theory via holography. The 5D charged black hole with asymptotic Schrodinger isometry in the bulk gravity side introduces parameters of background density and finite particle number into the boundary field theory. We propose the holographic dictionary, and realize a quantum phase transition of this fermionic liquid with fixed particle number by tuning the background density $\\beta$ at zero temperature. On the larger $\\beta$ side, we find the signal of a sharp quasiparticle pole on the spectral function A(k,w), indicating a well-defined Fermi surface. On the smaller $\\beta$ side, we find only a hump with no sharp peak for A(k,w), indicating the disappearance of Fermi surface. The dynamical exponent $z$ of quasiparticle dispersion goes from being Fermi-liquid-like $z\\simeq1$ scaling at larger $\\beta$ to a non-Fermi-liquid scaling $z\\simeq 3/2$ at smaller $\\beta$. By comparing the structure of Green's fu...

  1. Origin of Colossal Ionic Conductivity in Oxide Multilayers: Interface Induced Sublattice Disorder

    SciTech Connect (OSTI)

    Pennycook, Timothy J [ORNL; Beck, Matthew [Vanderbilt University; Varga, Kalman [ORNL; Varela del Arco, Maria [ORNL; Pennycook, Stephen J [ORNL; Pantelides, Sokrates T [ORNL

    2010-01-01T23:59:59.000Z

    Oxide ionic conductors typically operate at high temperatures, which limits their usefulness. Colossal room-temperature ionic conductivity was recently discovered in multilayers of yttria-stabilized zirconia (YSZ) and SrTiO3. Here we report density-functional calculations that trace the origin of the effect to a combination of lattice-mismatch strain and O-sublattice incompatibility. Strain alone in bulk YSZ enhances O mobility at high temperatures by inducing extreme O disorder. In multilayer structures, O-sublattice incompatibility causes the same extreme disorder at room temperature.

  2. Space- and Time-Resolved Mapping of Ionic Dynamic and Electroresistive Phenomena in Lateral Devices

    SciTech Connect (OSTI)

    Strelcov, Evgheni [ORNL; Jesse, Stephen [ORNL; Yen-Lin, Huang [National Chiao Tung University, Hsinchu, Taiwan; Yung-Chun, Teng [National Chiao Tung University, Hsinchu, Taiwan; Kravchenko, Ivan I [ORNL; Ying-Hao, Chu [National Chiao Tung University, Hsinchu, Taiwan; Kalinin, Sergei V [ORNL

    2013-01-01T23:59:59.000Z

    A novel scanning probe microscopy (SPM) based technique for probing local ionic and electronic transport and their dynamic behavior on the 10 ms 10 s scale is presented. The time-resolved Kelvin Probe Force Microscopy (tr-KPFM) allows mapping surface potential in both space and time domains, visualizing electronic and ionic charge dynamics and separating underlying processes based on their time responses. Here, tr-KPFM is employed to explore the interplay of the adsorbed surface ions and bulk oxygen vacancies and their role in the resistive switching in the Ca-substituted bismuth ferrite thin film.

  3. Extending the fast multipole method for charges inside a dielectric sphere in an ionic solvent: High-order

    E-Print Network [OSTI]

    Cai, Wei

    Extending the fast multipole method for charges inside a dielectric sphere in an ionic solvent 2007 Abstract As a sequel to our previous paper on extending the Fast Multipole Method (FMM; 78M25; 92B99 Keywords: Method of images; Fast multipole method; Reaction field; Ionic solvent

  4. Water dynamics at neutral and ionic interfaces Emily E. Fenn, Daryl B. Wong, and M. D. Fayer1

    E-Print Network [OSTI]

    Fayer, Michael D.

    Water dynamics at neutral and ionic interfaces Emily E. Fenn, Daryl B. Wong, and M. D. Fayer1 (sent for review June 12, 2009) The orientational dynamics of water at a neutral surfactant reverse, and the results are compared to orienta- tional relaxation of water interacting with an ionic interface

  5. THE JOURNAL OF CHEMICAL PHYSICS 138, 114105 (2013) Reorganization energy of electron transfer processes in ionic fluids

    E-Print Network [OSTI]

    Song, Xueyu

    2013-01-01T23:59:59.000Z

    solutions. Thus any reliable theoretical understanding of electron transfer reactions in ionic fluidsTHE JOURNAL OF CHEMICAL PHYSICS 138, 114105 (2013) Reorganization energy of electron transfer; published online 15 March 2013) The reorganization energy of electron transfer processes in ionic fluids

  6. Liquid class predictor for liquid handling of complex mixtures

    DOE Patents [OSTI]

    Seglke, Brent W. (San Ramon, CA); Lekin, Timothy P. (Livermore, CA)

    2008-12-09T23:59:59.000Z

    A method of establishing liquid classes of complex mixtures for liquid handling equipment. The mixtures are composed of components and the equipment has equipment parameters. The first step comprises preparing a response curve for the components. The next step comprises using the response curve to prepare a response indicator for the mixtures. The next step comprises deriving a model that relates the components and the mixtures to establish the liquid classes.

  7. Portable liquid collection electrostatic precipitator

    DOE Patents [OSTI]

    Carlson, Duane C.; DeGange, John J.; Halverson, Justin E.

    2005-10-18T23:59:59.000Z

    A portable liquid collection electrostatic collection precipitator for analyzing air is provided which is a relatively small, self-contained device. The device has a tubular collection electrode, a reservoir for a liquid, and a pump. The pump pumps the liquid into the collection electrode such that the liquid flows down the exterior of the collection electrode and is recirculated to the reservoir. An air intake is provided such that air to be analyzed flows through an ionization section to ionize analytes in the air, and then flows near the collection electrode where ionized analytes are collected. A portable power source is connected to the air intake and the collection electrode. Ionizable constituents in the air are ionized, attracted to the collection electrode, and precipitated in the liquid. The precipitator may also have an analyzer for the liquid and may have a transceiver allowing remote operation and data collection.

  8. Synthesis and Characterization of Simultaneous Electronic and Ionic Conducting Block Copolymers for Lithium Battery Electrodes

    E-Print Network [OSTI]

    Patel, Shrayesh

    2013-01-01T23:59:59.000Z

    Battery Electrodes by Shrayesh Naran Patel Abstract Synthesis and Characterizationand Characterization of Simultaneous Electronic and Ionic Conducting Block Copolymers for Lithium BatteryBattery Design ..10 1.6 Outline of Dissertation 12 Chapter 2 –Poly(3-alkylthiophene-block-ethylene oxide) Synthesis and Characterization .

  9. Understanding graphene production by ionic surfactant exfoliation: A molecular dynamics simulation study

    E-Print Network [OSTI]

    Simons, Jack

    Understanding graphene production by ionic surfactant exfoliation: A molecular dynamics simulation simulated sodium dodecyl sulfate (SDS) surfactant/water þ bilayer graphene mixture system to investigate two mechanisms of graphene exfoliation: changing the interlayer distance and sliding away the relative distance

  10. Ionic effects on silica optical fiber strength and models for fatigue V. V. Rondinella

    E-Print Network [OSTI]

    Matthewson, M. John

    Ionic effects on silica optical fiber strength and models for fatigue V. V. Rondinella M. J. Matthewson Rutgers University, Fiber Optic Materials Research Program P. 0. Box 909, Piscataway, NJ 08855, flaw free silica optical fiber shows significant differences from the bulk material for poorly

  11. The structure of pH dependent block copolymer micelles: charge and ionic strength dependence

    SciTech Connect (OSTI)

    Pople, John A

    2002-08-06T23:59:59.000Z

    We characterize the structures of various polyelectrolyte block copolymer micelles in dilute aqueous solution as a function of pH and ionic strength. The block copolymers carry a common core block 2-(diethylamino) ethyl methacrylate (DEAEMA) and one of three coronal blocks: 2-(dimethylamino) ethyl methacrylate (DMAEMA), polyethylene oxide (PEO), and DMAEMA whose side-chain amine groups are selectively quaternized with benzyl chloride (Q-DMAEMA). The PEO-DEAEMA, DMAEMA-DEAEMA, and Q-DMAEMA-DEAEMA copolymers form micelles with electrostatically neutral, weakly charged, and highly charged coronae, respectively. We adjust the fractional charge a on the DEAEMA and DMAEMA blocks by adjusting the solution pH. For DMAEMA-DEAEMA micelles increasing the fractional charge a swells the micelle corona while decreasing the aggregation number due to electrostatic repulsions. The decrease in aggregation number is also observed with increasing a for the PEO-DEAEMA and Q-DMAEMA-DEAEMA micelles, due to electrostatic repulsions between the hydrophobic DEAEMA blocks. Increasing the ionic strength causes the DMAEMA-DEAEMA micelle corona to shrink as the salt screens electrostatic repulsions within the corona. In all three copolymers increases in the ionic strength causes the micelle aggregation number to increase by screening the electrostatic repulsions between chains. Trends in the corona thickness with varying fractional charge and ionic strength are compared with a number of theoretical models providing additional insight into the micelle structure.

  12. Solid-State Electrochromic Devices via Ionic Self-Assembled Multilayers

    E-Print Network [OSTI]

    Heflin, Randy

    Solid-State Electrochromic Devices via Ionic Self-Assembled Multilayers (ISAM) of a Polyviologena-Galva´n, Harry W. Gibson, James R. Heflin* Introduction Electrochromic (EC) devices undergo reversible absorbance/ transmittance change on application of external voltage.[1] Since the first major report on electrochromism

  13. Rotational Relaxation of Ionic Molecules in Electrolyte Solutions. Anisotropy Relaxation and Molecular Dynamics Study

    E-Print Network [OSTI]

    Kurnikova, Maria

    and the metal cation. Conductivity measure- ments and ab initio electronic structure calculations are used structure and the solute dynamics occur for ionic solute molecules. Both experimental4-10 and theoretical11 of experimental studies, ab initio electronic struc- ture, and molecular dynamics (MD) simulation is used

  14. Liquid monobenzoxazine based resin system

    DOE Patents [OSTI]

    Tietze, Roger; Nguyen, Yen-Loan; Bryant, Mark

    2014-10-07T23:59:59.000Z

    The present invention provides a liquid resin system including a liquid monobenzoxazine monomer and a non-glycidyl epoxy compound, wherein the weight ratio of the monobenzoxazine monomer to the non-glycidyl epoxy compound is in a range of about 25:75 to about 60:40. The liquid resin system exhibits a low viscosity and exceptional stability over an extended period of time making its use in a variety of composite manufacturing methods highly advantageous.

  15. Supported liquid membrane electrochemical separators

    DOE Patents [OSTI]

    Pemsler, J. Paul (Lexington, MA); Dempsey, Michael D. (Revere, MA)

    1986-01-01T23:59:59.000Z

    Supported liquid membrane separators improve the flexibility, efficiency and service life of electrochemical cells for a variety of applications. In the field of electrochemical storage, an alkaline secondary battery with improved service life is described in which a supported liquid membrane is interposed between the positive and negative electrodes. The supported liquid membranes of this invention can be used in energy production and storage systems, electrosynthesis systems, and in systems for the electrowinning and electrorefining of metals.

  16. Process for preparing liquid wastes

    DOE Patents [OSTI]

    Oden, Laurance L. (Albany, OR); Turner, Paul C. (Albany, OR); O'Connor, William K. (Lebanon, OR); Hansen, Jeffrey S. (Corvallis, OR)

    1997-01-01T23:59:59.000Z

    A process for preparing radioactive and other hazardous liquid wastes for treatment by the method of vitrification or melting is provided for.

  17. Liquid crystal polyester thermosets

    DOE Patents [OSTI]

    Benicewicz, Brian C. (Los Alamos, NM); Hoyt, Andrea E. (Los Alamos, NM)

    1992-01-01T23:59:59.000Z

    The present invention provides (1) curable liquid crystalline polyester monomers represented by the formula: R.sup.1 --A.sup.1 --B.sup.1 --A.sup.2 --B.sup.2 --A.sup.3 --R.sup.2 where R.sup.1 and R.sup.2 are radicals selected from the group consisting of maleimide, substituted maleimide, nadimide, substituted naimide, ethynyl, and (C(R.sup.3).sub.2).sub.2 where R.sup.3 is hydrogen with the proviso that the two carbon atoms of (C(R.sup.3).sub.2).sub.2 are bound on the aromatic ring of A.sup.1 or A.sup.3 to adjacent carbon atoms, A.sup.1 and A.sup.3 are 1,4-phenylene and the same where said group contains one or more substituents selected from the group consisting of halo, e.g., fluoro, chloro, bromo, or iodo, nitro lower alkyl, e.g., methyl, ethyl, or propyl, alkoxy, e.g., methoxy, ethoxy, or propoxy, and fluoroalkyl, e.g., trifluoromethyl, pentafluoroethyl and the like, A.sup.2 is selected from the group consisting of 1,4-phenylene, 4,4'-biphenyl, 2,6-naphthylene and the same where said groups contain one or more substituents selected from the group consisting of halo, e.g., fluoro, chloro, bromo, or iodo, nitro, lower alkyl, e.g., methyl, ethyl, and propyl, lower alkoxy, e.g., methoxy, ethoxy, or propoxy, and fluoroalkyl or fluoroalkoxy, e.g., trifluoromethyl, pentafluoroethyl and the like, and B.sup.1 and B.sup.2 are selected from the group consisting of --C(O)--O-- and --O--C(O)--, (2) thermoset liquid crystalline polyester compositions comprised of heat-cured segments derived from monomers represented by the formula: R.sup.1 --A.sup.1 --B.sup.1 --A.sup.2 --B.sup.2 --A.sup.3 --R.sup.2 as described above, (3) curable blends of at least two of the polyester monomers and (4) processes of preparing the curable liquid crystalline polyester monomers.

  18. Lithium-loaded liquid scintillators

    DOE Patents [OSTI]

    Dai, Sheng (Knoxville, TN); Kesanli, Banu (Mersin, TR); Neal, John S. (Knoxville, TN)

    2012-05-15T23:59:59.000Z

    The invention is directed to a liquid scintillating composition containing (i) one or more non-polar organic solvents; (ii) (lithium-6)-containing nanoparticles having a size of up to 10 nm and surface-capped by hydrophobic molecules; and (iii) one or more fluorophores. The invention is also directed to a liquid scintillator containing the above composition.

  19. Method for treating liquid wastes

    DOE Patents [OSTI]

    Katti, K.V.; Volkert, W.A.; Singh, P.; Ketring, A.R.

    1995-12-26T23:59:59.000Z

    The method of treating liquid waste in a media is accomplished by exposing the media to phosphinimines and sequestering {sup 99}Tc from the media by the phosphinimine (PN) functionalities. The system for treating the liquid waste in the media includes extraction of {sup 99}TcO{sub 4}{sup {minus}} from aqueous solutions into organic solvents or mixed organic/polar media, extraction of {sup 99}Tc from solutions on a solid matrix by using a container containing PN functionalities on solid matrices including an inlet and outlet for allowing flow of media through an immobilized phosphinimine ligand system contained within the container. Also, insoluble suspensions of phosphinimine functionalities on solid matrices in liquid solutions or present on supported liquid membranes (SLM) can be used to sequester {sup 99}Tc from those liquids. 6 figs.

  20. Method for treating liquid wastes

    DOE Patents [OSTI]

    Katti, Kattesh V. (Columbia, MO); Volkert, Wynn A. (Columbia, MO); Singh, Prahlad (Columbia, MO); Ketring, Alan R. (Columbia, MO)

    1995-01-01T23:59:59.000Z

    The method of treating liquid waste in a media is accomplished by exposing the media to phosphinimines and sequestering .sup.99 Tc from the media by the phosphinimine (PN) functionalities. The system for treating the liquid waste in the media includes extraction of .sup.99 TcO.sub.4.sup.- from aqueous solutions into organic solvents or mixed organic/polar media, extraction of .sup.99 Tc from solutions on a solid matrix by using a container containing PN functionalities on solid matrices including an inlet and outlet for allowing flow of media through an immobilized phosphinimine ligand system contained within the container. Also, insoluble suspensions of phosphinimine functionalities on solid matrices in liquid solutions or present on supported liquid membranes (SLM) can be used to sequester .sup.99 Tc from those liquids.

  1. Singular Limits in Polymer Stabilized Liquid Crystals

    E-Print Network [OSTI]

    1910-31-00T23:59:59.000Z

    We investigate equilibrium configurations for a polymer stabilized liquid crys- tal material ... eling the cross section of the liquid crystal-polymer fiber composite.

  2. Imaging Liquids Using Microfluidic Cells. | EMSL

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    the difficulty in working with liquids with high volatility. Recent development in microfluidics enabled and increased our capabilities to study liquid in situ using surface...

  3. Liquid Hydrogen Delivery - Strategic Directions for Hydrogen...

    Broader source: Energy.gov (indexed) [DOE]

    Liquid Hydrogen Delivery - Strategic Directions for Hydrogen Delivery Workshop Liquid Hydrogen Delivery - Strategic Directions for Hydrogen Delivery Workshop Targets, barriers and...

  4. Study of the aggregation behaviour of egg yolk lecithin/bile salt mixtures by increasing the ionic strength 

    E-Print Network [OSTI]

    Madenci, Dilek

    2009-11-25T23:59:59.000Z

    This thesis describes a study of the aggregational behaviour of egg yolk lecithin (EYL), a natural lecithin, and bile salt mixtures especially with respect to an increase of the ionic strength of the solvent. Mixtures ...

  5. Atomic Scale Design and Three-Dimensional Simulation of Ionic Diffusive Nanofluidic Channels

    E-Print Network [OSTI]

    Park, Jin Kyoung; We, Guo-Wei

    2015-01-01T23:59:59.000Z

    Recent advance in nanotechnology has led to rapid advances in nanofluidics, which has been established as a reliable means for a wide variety of applications, including molecular separation, detection, crystallization and biosynthesis. Although atomic and molecular level consideration is a key ingredient in experimental design and fabrication of nanfluidic systems, atomic and molecular modeling of nanofluidics is rare and most simulations at nanoscale are restricted to one- or two-dimensions in the literature, to our best knowledge. The present work introduces atomic scale design and three-dimensional (3D) simulation of ionic diffusive nanofluidic systems. We propose a variational multiscale framework to represent the nanochannel in discrete atomic and/or molecular detail while describe the ionic solution by continuum. Apart from the major electrostatic and entropic effects, the non-electrostatic interactions between the channel and solution, and among solvent molecules are accounted in our modeling. We deriv...

  6. Solid-Liquid Interfacial Premelting

    E-Print Network [OSTI]

    Yang, Yang; Asta, Mark; Laird, Brian Bostian

    2013-02-28T23:59:59.000Z

    liquid-liquid miscibility gap, negligible solubility of Pb in the Al solid phase, and a large melting point separa- tion (600 K for Pb and 933 K for Al). We have previously reported results from MD simulations on this system at 625 K, a temperature just... undergoes a roughening transition about 100 K below the melting point of Al. Simulation details.—In our simulations of the Al-Pb solid-liquid interface, we employ a classical many-body potential developed by Landa et al. [42] to model the inter- atomic...

  7. Electronically and ionically conductive porous material and method for manufacture of resin wafers therefrom

    DOE Patents [OSTI]

    Lin, YuPo J. (Naperville, IL); Henry, Michael P. (Batavia, IL); Snyder, Seth W. (Lincolnwood, IL)

    2008-11-18T23:59:59.000Z

    An electrically and ionically conductive porous material including a thermoplastic binder and one or more of anion exchange moieties or cation exchange moieties or mixtures thereof and/or one or more of a protein capture resin and an electrically conductive material. The thermoplastic binder immobilizes the moieties with respect to each other but does not substantially coat the moieties and forms the electrically conductive porous material. A wafer of the material and a method of making the material and wafer are disclosed.

  8. Comment on `Nanoconfinement-enhanced conformational response of single DNA molecules to changes in ionic environment'

    E-Print Network [OSTI]

    Madhavi Krishnan; Eugene P. Petrov

    2008-05-14T23:59:59.000Z

    In the present Comment we show that, contrary to the recent findings of Reisner et al. [Phys. Rev. Lett. 99, 058302 (2007)], the excluded volume effect does not play an important role in determining DNA behavior in nanochannels at low ionic strength. We argue that the DNA extension data are described very well without the notion of an effective polymer width using the entropic depletion theory due to Odijk.

  9. Electronically and ionically conductive porous material and method for manufacture of resin wafers therefrom

    DOE Patents [OSTI]

    Lin, YuPo J. (Naperville, IL); Henry, Michael P. (Batavia, IL); Snyder, Seth W. (Lincolnwood, IL)

    2011-07-12T23:59:59.000Z

    An electrically and ionically conductive porous material including a thermoplastic binder and one or more of anion exchange moieties or cation exchange moieties or mixtures thereof and/or one or more of a protein capture resin and an electrically conductive material. The thermoplastic binder immobilizes the moieties with respect to each other but does not substantially coat the moieties and forms the electrically conductive porous material. A wafer of the material and a method of making the material and wafer are disclosed.

  10. Nonlinear theory of ionic sound waves in a hot quantum-degenerate electron-positron-ion plasma

    SciTech Connect (OSTI)

    Dubinov, A. E., E-mail: dubinov-ae@yandex.ru; Sazonkin, M. A., E-mail: figma@mail.r [Sarov State Physicotechnical Institute (Russian Federation)

    2010-11-15T23:59:59.000Z

    A collisionless nonmagnetized e-p-i plasma consisting of quantum-degenerate gases of ions, electrons, and positrons at nonzero temperatures is considered. The dispersion equation for isothermal ionic sound waves is derived and analyzed, and an exact expression is obtained for the linear velocity of ionic sound. Analysis of the dispersion equation has made it possible to determine the ranges of parameters in which nonlinear solutions in the form of solitons should be sought. A nonlinear theory of isothermal ionic sound waves is developed and used for obtaining and analyzing the exact solution to the system of initial equations. Analysis has been carried out by the method of the Bernoulli pseudopotential. The ranges of phase velocities of periodic ionic sound waves and soliton velocities are determined. It is shown that in the plasma under investigation, these ranges do not overlap and that the soliton velocity cannot be lower than the linear velocity of ionic sound. The profiles of physical quantities in a periodic wave and in a soliton are constructed, as well as the dependences of the velocity of sound and the critical velocity on the ionic concentration in the plasma. It is shown that these velocities increase with the ion concentration.

  11. Pressure effect on ionic conductivity in yttrium-oxide-doped single-crystal zirconium oxide

    SciTech Connect (OSTI)

    Park, E.T.; Park, J.H.

    1998-06-01T23:59:59.000Z

    In this study, the authors investigated the effect of pressure on the ionic conductivity of a 9.5 mol% yttria-stabilized zirconia (YSZ) single crystal. The experiment was conducted in the elastic region, and the oxygen ion transport number was unity (t{sub ion} > 0.99999). A conventional four-probe DC method was used to measure the ionic conductivity of the rectangular-shaped sample under uniaxial pressures up to 600 atm at 750 C in air. Measured ionic conductivity decreased as applied pressure increased. Based on henry Eyring`s absolute reaction rate theory, which states that the calculated activation volume has a positive value ({Delta}V{sup 2} = 2.08 cm{sup 3}/mol of O{sup {minus}2}) for oxygen ion transport in the fluoride cubic lattice, they concluded that the results they obtained could be explained by an oxygen ion transport mechanism. This mechanism can explain the fact that the interionic distance increases during oxygen ion transport from one unit cell to neighboring unit cells.

  12. Ionic exclusion phase transition in neutral and weakly charged cylindrical nanopores

    E-Print Network [OSTI]

    Sahin Buyukdagli; Manoel Manghi; John Palmeri

    2011-05-13T23:59:59.000Z

    A field theoretic variational approach is introduced to study ion penetration into water-filled cylindrical nanopores in equilibrium with a bulk reservoir. It is shown that (i) an ion located in a neutral pore undergoes two opposing mechanisms: the deformation of its surrounding ionic cloud of opposite charge, with respect to the reservoir, which increases the surface tension and tends to exclude ions form the pore, and (ii) the attractive contribution to the ion self-energy of the repulsive image forces associated with the dielectric jump between the solvent and the pore wall, which becomes more and more screened when ions enter the pore. For pore radii around 1 nm and bulk concentrations lower than 0.2 mol/L, this mechanism leads to a first-order phase transition, similar to capillary "evaporation", from an ionic-penetration state to an ionic-exclusion state. The discontinuous phase transition survives within the biological concentration range (~ 0.15 mol/L) for small enough membrane dielectric permittivities (characterized by two regimes: at low reservoir concentration or small pore radii, coions are excluded and the energy barrier for counterions is reduced but image forces remain strong enough, so that the counterion partition coefficient in the pore decreases with increasing reservoir concentration up to a characteristic value; for larger reservoir concentrations, image forces are screened and the partition coefficient of counterions increases with the reservoir electrolyte concentration.

  13. Effect of low energy oxygen ion beam irradiation on ionic conductivity of solid polymer electrolyte

    SciTech Connect (OSTI)

    Manjunatha, H., E-mail: gnk-swamy@blr.amrita.edu; Kumaraswamy, G. N., E-mail: gnk-swamy@blr.amrita.edu [Department of Physics, Amrita Vishwa Vidyapeetham, Bengaluru-560035 (India); Damle, R. [Department of Physics, Bangalore University, Bengaluru-560056 (India)

    2014-04-24T23:59:59.000Z

    Over the past three decades, solid polymer electrolytes (SPEs) have drawn significant attention of researchers due to their prospective commercial applications in high energy-density batteries, electrochemical sensors and super-capacitors. The optimum conductivity required for such applications is about 10{sup ?2} – 10{sup ?4} S/cm, which is hard to achieve in these systems. It is known that the increase in the concentration of salt in the host polymer results in a continuous increase in the ionic conductivity. However, there is a critical concentration of the salt beyond which the conductivity decreases due to formation of ion pairs with no net charge. In the present study, an attempt is made to identify the concentration at which ion pair formation occurs in PEO: RbBr. We have attempted to modify microstructure of the host polymer matrix by low energy ion (Oxygen ion, O{sup +1} with energy 100 keV) irradiation. Ionic conductivity measurements in these systems were carried out using Impedance Spectroscopy before and after irradiation to different fluencies of the oxygen ion. It is observed that the conductivity increases by one order in magnitude. The increase in ionic conductivity may be attributed to the enhanced segmental motion of the polymer chains. The study reveals the importance of ion irradiation as an effective tool to enhance conductivity in SPEs.

  14. Atomic Scale Design and Three-Dimensional Simulation of Ionic Diffusive Nanofluidic Channels

    E-Print Network [OSTI]

    Jin Kyoung Park; Kelin Xia; Guo-Wei We

    2015-03-02T23:59:59.000Z

    Recent advance in nanotechnology has led to rapid advances in nanofluidics, which has been established as a reliable means for a wide variety of applications, including molecular separation, detection, crystallization and biosynthesis. Although atomic and molecular level consideration is a key ingredient in experimental design and fabrication of nanfluidic systems, atomic and molecular modeling of nanofluidics is rare and most simulations at nanoscale are restricted to one- or two-dimensions in the literature, to our best knowledge. The present work introduces atomic scale design and three-dimensional (3D) simulation of ionic diffusive nanofluidic systems. We propose a variational multiscale framework to represent the nanochannel in discrete atomic and/or molecular detail while describe the ionic solution by continuum. Apart from the major electrostatic and entropic effects, the non-electrostatic interactions between the channel and solution, and among solvent molecules are accounted in our modeling. We derive generalized Poisson-Nernst-Planck (PNP) equations for nanofluidic systems. Mathematical algorithms, such as Dirichlet to Neumann mapping and the matched interface and boundary (MIB) methods are developed to rigorously solve the aforementioned equations to the second-order accuracy in 3D realistic settings. Three ionic diffusive nanofluidic systems, including a negatively charged nanochannel, a bipolar nanochannel and a double-well nanochannel are designed to investigate the impact of atomic charges to channel current, density distribution and electrostatic potential. Numerical findings, such as gating, ion depletion and inversion, are in good agreements with those from experimental measurements and numerical simulations in the literature.

  15. Gaseous and Liquid Hydrogen Storage

    Broader source: Energy.gov [DOE]

    Today's state of the art for hydrogen storage includes 5,000- and 10,000-psi compressed gas tanks and cryogenic liquid hydrogen tanks for on-board hydrogen storage.

  16. Fluorescent optical liquid level sensor

    DOE Patents [OSTI]

    Weiss, Jonathan D. (Albuquerque, NM)

    2001-01-01T23:59:59.000Z

    A liquid level sensor comprising a transparent waveguide containing fluorescent material that is excited by light of a first wavelength and emits at a second, longer wavelength. The upper end of the waveguide is connected to a light source at the first wavelength through a beveled portion of the waveguide such that the input light is totally internally reflected within the waveguide above an air/liquid interface in a tank but is transmitted into the liquid below this interface. Light is emitted from the fluorescent material only in those portions of the waveguide that are above the air/liquid interface, to be collected at the upper end of the waveguide by a detector that is sensitive only to the second wavelength. As the interface moves down in the tank, the signal strength from the detector will increase.

  17. Liquid measurement - Techniques and problems

    SciTech Connect (OSTI)

    Caffey, B.R.

    1984-04-01T23:59:59.000Z

    This paper reviews a few liquid measurement techniques and their associated problems. In measuring liquid petroleum gas, the first obstacle to overcome is accomodating some form of volumetric measurement. This is usually accomplished by orifice, positive displacement, or turbine meters. Each of the three established methods is covered extensively by industry standards in the API Manual of Petroleum Standards. If the operator follows these standards, very accurate results can be achieved.

  18. Calculate viscosities for 355 liquids

    SciTech Connect (OSTI)

    Yaws, C.L.; Lin, Xiaoyan; Li Bu (Lamar Univ., TX (United States))

    1994-04-01T23:59:59.000Z

    Liquid viscosities are important factors in process design and operation. The viscosity of a liquid determines its flow properties, such as velocity and pressure drop. In addition, the heat- and mass-transfer characteristics of a liquid are affected by its viscosity. An equation can be used to calculate liquid viscosities as a function of temperature. In the accompanying table, regression coefficients are included for 355 compounds with five, six or seven carbon atoms--generally the most-widely used in the chemical and petroleum industries. To calculate the viscosity of a liquid at any temperature between its melting and critical points (T[sub min] and T[sub max]), use the following equation: log[sub 10] [eta][sub liq] = A + B/T + CT + DT[sup 2] where [eta][sub liq] = viscosity, cP, A,B,C and D = regression coefficients, and T = liquid temperature, K. Insert the temperature into the equation along with the corresponding regression coefficients from the table. The chemical formulae are listed by the number of carbon atoms.

  19. Adaptive Liquid Crystal Windows

    SciTech Connect (OSTI)

    Taheri, Bahman; Bodnar, Volodymyr

    2011-12-31T23:59:59.000Z

    Energy consumption by private and commercial sectors in the U.S. has steadily grown over the last decade. The uncertainty in future availability of imported oil, on which the energy consumption relies strongly, resulted in a dramatic increase in the cost of energy. About 20% of this consumption are used to heat and cool houses and commercial buildings. To reduce dependence on the foreign oil and cut down emission of greenhouse gases, it is necessary to eliminate losses and reduce total energy consumption by buildings. To achieve this goal it is necessary to redefine the role of the conventional windows. At a minimum, windows should stop being a source for energy loss. Ideally, windows should become a source of energy, providing net gain to reduce energy used to heat and cool homes. It is possible to have a net energy gain from a window if its light transmission can be dynamically altered, ideally electronically without the need of operator assistance, providing optimal control of the solar gain that varies with season and climate in the U.S. In addition, the window must not require power from the building for operation. Resolution of this problem is a societal challenge and of national interest and will have a broad global impact. For this purpose, the year-round, allclimate window solution to provide an electronically variable solar heat gain coefficient (SHGC) with a wide dynamic range is needed. AlphaMicron, Inc. (AMI) developed and manufactured 1ft × 1ft prototype panels for the world’s first auto-adjusting Adaptive Liquid Crystal Windows (ALCWs) that can operate from sunlight without the need for external power source and demonstrate an electronically adjustable SHGC. This novel windows are based on AlphaMicron’s patented e-Tint® technology, a guesthost liquid crystal system implemented on flexible, optically clear plastic films. This technology is suitable both for OEM and aftermarket (retro-fitting) lamination to new and existing windows. Low level of power consumption by ALCWs allows for on-board power electronics for automatic matching of transmission through windows to varying climate conditions without drawing the power from the power grid. ALCWs are capable of transmitting more sunlight in winters to assist in heating and less sunlight in summers to minimize overheating. As such, they can change the window from being a source of energy loss to a source of energy gain. In addition, the scalable AMI’s roll-to-roll process, proved by making 1ft × 1ftALCW prototype panels, allows for cost-effective production of large-scale window panels along with capability to change easily their color and shape. In addition to architectural glazing in houses and commercial buildings, ALCWs can be used in other applications where control of sunlight is needed, such as green houses, used by commercial produce growers and botanical gardens, cars, aircrafts, etc.

  20. Nanophosphor composite scintillator with a liquid matrix

    DOE Patents [OSTI]

    McKigney, Edward Allen (Los Alamos, NM); Burrell, Anthony Keiran (Los Alamos, NM); Bennett, Bryan L. (Los Alamos, NM); Cooke, David Wayne (Santa Fe, NM); Ott, Kevin Curtis (Los Alamos, NM); Bacrania, Minesh Kantilal (Los Alamos, NM); Del Sesto, Rico Emilio (Los Alamos, NM); Gilbertson, Robert David (Los Alamos, NM); Muenchausen, Ross Edward (Los Alamos, NM); McCleskey, Thomas Mark (Los Alamos, NM)

    2010-03-16T23:59:59.000Z

    An improved nanophosphor scintillator liquid comprises nanophosphor particles in a liquid matrix. The nanophosphor particles are optionally surface modified with an organic ligand. The surface modified nanophosphor particle is essentially surface charge neutral, thereby preventing agglomeration of the nanophosphor particles during dispersion in a liquid scintillator matrix. The improved nanophosphor scintillator liquid may be used in any conventional liquid scintillator application, including in a radiation detector.

  1. Demonstration of an Electrochemical Liquid Cell for Operando Transmission Electron Microscopy Observation of the Lithiation/Delithiation Behavior of Si Nanowire Battery Anodes

    SciTech Connect (OSTI)

    Gu, Meng; Parent, Lucas R.; Mehdi, Beata L.; Unocic, Raymond R.; Mcdowell, Matthew T.; Sacci, Robert L.; Xu, Wu; Connell, Justin G.; Xu, Pinghong; Abellan Baeza, Patricia; Chen, Xilin; Zhang, Yaohui; Perea, Daniel E.; Evans, James E.; Lauhon, Lincoln; Zhang, Jiguang; Liu, Jun; Browning, Nigel D.; Cui, Yi; Arslan, Ilke; Wang, Chong M.

    2013-12-11T23:59:59.000Z

    Over the last few years, in-situ transmission electron microscopy (TEM) studies of lithium ion batteries using an open-cell configuration have helped us to gain fundamental insights into the structural and chemical evolution of the electrode materials in real time. In the standard open-cell configuration, the electrolyte is either solid lithium oxide or an ionic liquid, which is point-contacted with the electrode. This cell design is inherently different from a real battery, where liquid electrolyte forms conformal contact with electrode materials. The knowledge learnt from open cells can deviate significantly from the real battery, calling for operando TEM technique with conformal liquid electrolyte contact. In this paper, we developed an operando TEM electrochemical liquid cell to meet this need, providing the configuration of a real battery and in a relevant liquid electrolyte. To demonstrate this novel technique, we studied the lithiation/delithiation behavior of single Si nanowires. Some of lithiation/delithation behaviors of Si obtained using the liquid-cell are consistent with the results from the open-cell studies. However, we also discovered new insights different from the open cell configuration - the dynamics of the electrolyte and, potentially, a future quantitative characterization of the SEI layer formation and structural and chemical evolution.

  2. Liquid Cooling in Data Centers

    SciTech Connect (OSTI)

    Cader, Tahir; Sorell,, Vali; Westra, Levi; Marquez, Andres

    2009-05-01T23:59:59.000Z

    Semiconductor manufacturers have aggressively attacked the problem of escalating microprocessor power consumption levels. Today, server manufacturers can purchase microprocessors that currently have power consumption levels capped at 100W maximum. However, total server power levels continue to increase, with the increase in power consumption coming from the supportin chipsets, memory, and other components. In turn, full rack heat loads are very aggressivley climbing as well, and this is making it increasingly difficult and cost-prohibitive for facility owners to cool these high power racks. As a result, facilities owners are turning to alternative, and more energy efficient, cooling solutions that deploy liquids in one form or another. The paper discusses the advent of the adoption of liquid-cooling in high performance computing centers. An overview of the following competing rack-based, liquid-cooling, technologies is provided: in-row, above rack, refrigerated/enclosed rack, rear door heat exchanger, and device-level (i.e., chip-level). Preparation for a liquid-cooled data center, retroft and greenfield (new), is discussed, with a focus on the key issues that are common to all liquid-cooling technologies that depend upon the delivery of water to the rack (or in some deployments, a Coolant Distribution Unit). The paper then discusses, in some detail, the actual implementation and deployment of a liquid device-level cooled (spray cooled) supercomputer at the Pacific Northwest National Laboratory. Initial results from a successful 30 day compliance test show excellent hardware stability, operating system (OS) and software stack stability, application stability and performance, and an availability level that exceeded expectations at 99.94%. The liquid-cooled supercomputer achieved a peak performance of 9.287 TeraFlops, which placed it at number 101 in the June 2007 Top500 fastest supercomputers worldwide. Long-term performance and energy efficiency testing is currently underway, and detailed results will be reported in upcoming publications.

  3. Liquid membrane purification of biogas

    SciTech Connect (OSTI)

    Majumdar, S.; Guha, A.K.; Lee, Y.T.; Papadopoulos, T.; Khare, S. (Stevens Inst. of Tech., Hoboken, NJ (United States). Dept. of Chemistry and Chemical Engineering)

    1991-03-01T23:59:59.000Z

    Conventional gas purification technologies are highly energy intensive. They are not suitable for economic removal of CO{sub 2} from methane obtained in biogas due to the small scale of gas production. Membrane separation techniques on the other hand are ideally suited for low gas production rate applications due to their modular nature. Although liquid membranes possess a high species permeability and selectivity, they have not been used for industrial applications due to the problems of membrane stability, membrane flooding and poor operational flexibility, etc. A new hollow-fiber-contained liquid membrane (HFCLM) technique has been developed recently. This technique overcomes the shortcomings of the traditional immobilized liquid membrane technology. A new technique uses two sets of hydrophobic, microporous hollow fine fibers, packed tightly in a permeator shell. The inter-fiber space is filled with an aqueous liquid acting as the membrane. The feed gas mixture is separated by selective permeation of a species through the liquid from one fiber set to the other. The second fiber set carries a sweep stream, gas or liquid, or simply the permeated gas stream. The objectives (which were met) of the present investigation were as follows. To study the selective removal of CO{sub 2} from a model biogas mixture containing 40% CO{sub 2} (the rest being N{sub 2} or CH{sub 4}) using a HFCLM permeator under various operating modes that include sweep gas, sweep liquid, vacuum and conventional permeation; to develop a mathematical model for each mode of operation; to build a large-scale purification loop and large-scale permeators for model biogas separation and to show stable performance over a period of one month.

  4. Liquid-phase chromatography detector

    DOE Patents [OSTI]

    Voigtman, E.G.; Winefordner, J.D.; Jurgensen, A.R.

    1983-11-08T23:59:59.000Z

    A liquid-phase chromatography detector comprises a flow cell having an inlet tubular conduit for receiving a liquid chromatographic effluent and discharging it as a flowing columnar stream onto a vertically adjustable receiving surface spaced apart from and located vertically below and in close proximity to the discharge end of the tubular conduit; a receiver adapted to receive liquid overflowing from the receiving surface; an exit conduit for continuously removing liquid from the receiver; a light source for focusing fluorescence-producing light pulses on the flowing columnar stream as it passes from the outlet of the conduit to the receiving surface and a fluorescence detector to detect the produced fluorescence; a source of light pulse for producing acoustic waves in the columnar stream as it passes from the conduit outlet to the receiving surface; and a piezoelectric transducer adapted to detect those waves; and a source of bias voltage applied to the inlet tubular conduit and adapted to produce ionization of the liquid flowing through the flow cell so as to produce photocurrents therein and an electrical system to detect and record the photocurrents. This system is useful in separating and detecting individual chemical compounds from mixtures thereof. 5 figs.

  5. Are polar liquids less simple?

    E-Print Network [OSTI]

    D. Fragiadakis; C. M. Roland

    2012-08-28T23:59:59.000Z

    Strong correlation between equilibrium fluctuations of the potential energy, U, and the virial, W, is a characteristic of a liquid that implies the presence of certain dynamic properties, such as density scaling of the relaxation times and isochronal superpositioning of the relaxation function. In this work we employ molecular dynamics simulations (mds) on methanol and two variations, lacking hydrogen bonds and a dipole moment, to assess the connection between the correlation of U and W and these dynamic properties. We show, in accord with prior results of others [T.S. Ingebrigtsen, T.B. Schroder, J.C. Dyre, Phys. Rev. X 2, 011011 (2012).], that simple van der Waals liquids exhibit both strong correlations and the expected dynamic behavior. However, for polar liquids this correspondence breaks down - weaker correlation between U and W is not associated with worse conformance to density scaling or isochronal superpositioning. The reason for this is that strong correlation between U and W only requires their proportionality, whereas the expected dynamic behavior depends primarily on constancy of the proportionality constant for all state points. For hydrogen-bonded liquids, neither strong correlation nor adherence to the dynamic properties is observed; however, this nonconformance is not directly related to the concentration of hydrogen bonds, but rather to the greater deviation of the intermolecular potential from an inverse power law (IPL). Only (hypothetical) liquids having interactions governed strictly by an IPL are perfectly correlating and exhibit the consequent dynamic properties over all thermodynamic conditions.

  6. Fragmentation of suddenly heated liquids

    SciTech Connect (OSTI)

    Blink, J.A.

    1985-03-01T23:59:59.000Z

    Fragmentation of free liquids in Inertial Confinement Fusion reactors could determine the upper bound on reactor pulse rate. The x-ray ablated materials must cool and recondense to allow driver beam propagation. The increased surface area caused by fragmentation will enhance the cooling and condensation rates. Relaxation from the suddenly heated state will move a liquid into the negative pressure region under the liquid-vapor P-V dome. The lithium equation of state was used to demonstrate that neutron-induced vaporization uses only a minor fraction of the added heat, much less than would be required to drive the expansion. A 77% expansion of the lithium is required before the rapid vaporization process of spinodal decomposition could begin, and nucleation and growth are too slow to contribute to the expansion.

  7. Mixed Ionic and Electonic Conductors for Hydrogen Generation and Separation: A New Approach

    SciTech Connect (OSTI)

    Srikanth Gopalan

    2006-12-31T23:59:59.000Z

    Composite mixed conductors comprising one electronic conducting phase, and one ionic conducting phase (MIECs) have been developed in this work. Such MIECs have applications in generating and separating hydrogen from hydrocarbon fuels at high process rates and high purities. The ionic conducting phase comprises of rare-earth doped ceria and the electronic conducting phase of rare-earth doped strontium titanate. These compositions are ideally suited for the hydrogen separation application. In the process studied in this project, steam at high temperatures is fed to one side of the MIEC membrane and hydrocarbon fuel or reformed hydrocarbon fuel to the other side of the membrane. Oxygen is transported from the steam side to the fuel side down the electrochemical potential gradient thereby enriching the steam side flow in hydrogen. The remnant water vapor can then be condensed to obtain high purity hydrogen. In this work we have shown that two-phase MIECs comprising rare-earth ceria as the ionic conductor and doped-strontium titanate as the electronic conductor are stable in the operating environment of the MIEC. Further, no adverse reaction products are formed when these phases are in contact at elevated temperatures. The composite MIECs have been characterized using a transient electrical conductivity relaxation technique to measure the oxygen chemical diffusivity and the surface exchange coefficient. Oxygen permeation and hydrogen generation rates have been measured under a range of process conditions and the results have been fit to a model which incorporates the oxygen chemical diffusivity and the surface exchange coefficient from the transient measurements.

  8. Liquid soap film generates electricity

    E-Print Network [OSTI]

    Ahmad Amjadi; Sadegh Feiz; Reza Montazeri Namin

    2014-04-24T23:59:59.000Z

    We have observed that a rotating liquid soap film generates electricity when placed between two non-contact electrodes with a sufficiently large potential difference. In our experiments suspended liquid film (water + soap film) is formed on the surface of a circular frame, which is forced to rotate in the $x-y$ horizontal plane by a motor. This system is located at the center of two capacitor-like vertical plates to apply an external electric voltage difference in the $x-$direction. The produced electric current is collected from the liquid film using two conducting electrodes that are separated in the $y-$direction. We previously reported that a liquid film in an external electric field rotates when an electric current passes through it, naming it the liquid film motor (LFM). In this paper we report a novel technique, in which a similar device can be used as an electric generator, converting the rotating mechanical energy to electrical energy. The liquid film electric generator (LFEG) is in stark contrast to the LFM, both of which could be designed similarly in very small scales like micro scales with different applications. Although the device is comparable to commercial electric motors or electric generators, there is a significant difference in their working principles. Usually in an electric motor or generator the magnetic field causes the driving force, while in a LFM or LFEG the Coulomb force is the driving force. This fact is also interesting from the Bio-science point of view and brings a similarity to bio motors. Here we have investigated the electrical characteristics of such a generator for the first time experimentally and modelled the phenomenon with electroconvection governing equations. A numerical simulation is performed using the local approximation for the charge-potential relation and results are in qualitative agreement with experiments.

  9. Effect of Ionic Stabilization on Vertical Movement in Expansive Subgrade Soils in Texas

    E-Print Network [OSTI]

    Hariharan, Narain

    2013-07-31T23:59:59.000Z

    of loss of serviceability (?PSI) using the measured Mr and vertical movement values. The iii analysis indicate a significant reduction in drop of Mr values of the lime and EcSS-3000 treated soils and a marked improvement in cracking and subgrade... rutting characteristics of the pavements. An average reduction in ?PSI of the pavements by 0.2 to 0.3 points was observed on the stabilized soils. This study on expansive subgrades and the associated effects of ionic stabilization have yielded...

  10. Ionic conductivity and dielectric relaxation in {gamma}-irradiated TlGaTe{sub 2} crystals

    SciTech Connect (OSTI)

    Sardarli, R. M., E-mail: sardarli@yahoo.com; Samedov, O. A.; Abdullayev, A. P. [National Academy of Sciences of Azerbaijan, Institute of Radiation Problems (Azerbaijan); Huseynov, E. K. [National Academy of Sciences of Azerbaijan, Institute of Physics (Azerbaijan); Salmanov, F. T.; Alieva, N. A.; Agaeva, R. Sh. [National Academy of Sciences of Azerbaijan, Institute of Radiation Problems (Azerbaijan)

    2013-05-15T23:59:59.000Z

    The switching effect, field and temperature dependences of the permittivity and conductivity of TlGaTe{sub 2} crystals subjected to various {gamma}-irradiation doses are studied. Under rather low electric fields, the phenomenon of threshold switching with an S-shaped current-voltage characteristic containing a portion with negative differential resistance is observed in the crystals. In the region of critical voltages, current and voltage oscillations and imposed modulation are observed. Possible mechanisms of switching, ionic conductivity, disorder, and electrical instability in TlGaTe{sub 2} crystals are discussed.

  11. Method of measuring a liquid pool volume

    DOE Patents [OSTI]

    Garcia, G.V.; Carlson, N.M.; Donaldson, A.D.

    1991-03-19T23:59:59.000Z

    A method of measuring a molten metal liquid pool volume and in particular molten titanium liquid pools is disclosed, including the steps of (a) generating an ultrasonic wave at the surface of the molten metal liquid pool, (b) shining a light on the surface of a molten metal liquid pool, (c) detecting a change in the frequency of light, (d) detecting an ultrasonic wave echo at the surface of the molten metal liquid pool, and (e) computing the volume of the molten metal liquid. 3 figures.

  12. New airport liquid analysis system undergoes testing at Albuquerque...

    Broader source: All U.S. Department of Energy (DOE) Office Webpages (Extended Search)

    New airport liquid analysis system New airport liquid analysis system undergoes testing at Albuquerque International Sunport A new tool that distinguishes potential-threat liquids...

  13. THERMODYNAMICS OF SOLID AND LIQUID GROUP III-V ALLOYS

    E-Print Network [OSTI]

    Anderson, T.J.

    2011-01-01T23:59:59.000Z

    a high temperature heat capacity for liquid gallium which isthe molar heat capacity of the stoichiometric liquid and theheat capacity of the supercooled stoichiometric binary liquid

  14. Vapor-liquid equilibrium of the Mg(NO/sub 3/)/sub 2/-HNO/sub 3/-H/sub 2/O system

    SciTech Connect (OSTI)

    Thompson, B.E.; Derby, J.J.; Stalzer, E.H.

    1983-06-01T23:59:59.000Z

    The vapor-liquid equilibrium of the Mg(NO/sub 3/)/sub 2/-HNO/sub 3/-H/sub 2/O system in concentrations of 0 to 70 wt % Mg(NO/sub 3/)/sub 2/ and 0 to 75 wt % HNO/sub 3/ at atmospheric pressure was correlated by two approaches. One was based on a dissociation equilibrium expression in which the activities of the reacting species (HNO/sub 3/, NO/sub 3//sup -/, and H/sup +/) were approximated with mole fractions. The activity coefficients of the undissociated HNO/sub 3/ and H/sub 2/O were correlated as functions of the concentrations of magnesium nitrate and nitric acid by second-order polynomials. The average absolute difference between predicted and experimental values was 8% for the mole fraction of acid in the vapor and 8/sup 0/K for the bubble-point temperature. The second approach was to correlate the mean ionic rational activity coefficient of water with a form of the excess Gibbs energy composed of two terms. One term, a function of the ionic strength, accounts for the coulombic (ionic) interactions; the other term accounts for the non-coulombic (molecular) interactions. The average absolute difference between predicted and experimental values was 9% for the mole fraction of acid in the vapor, and 10/sup 0/K for the bubble-point temperature.

  15. Improving the Regeneration of CO?-Binding Organic Liquids with a Polarity Change

    SciTech Connect (OSTI)

    Mathias, Paul M.; Afshar, Kash; Zheng, Feng; Bearden, Mark D.; Freeman, Charles J.; Andrea, Tamer; Koech, Phillip K.; Kutnyakov, Igor V.; Zwoster, Andy; Smith, Arnold R.; Jessop, Philip G.; Nik, Omid Ghafari; Heldebrant, David J.

    2013-01-01T23:59:59.000Z

    This paper describes an unusual solvent regeneration method unique to CO?BOLs and other switchable ionic liquids; utilizing changes in polarity to shift the free energy of the system. The degree of CO? loading in CO?BOLs is known to control the polarity of the solvent; conversely, polarity could be exploited as a means to control CO? loading. In this process, a chemically inert non-polar “antisolvent” is added to aid in de-complexing CO? from a CO?-rich CO?BOL. The addition of this polarity assist reduces temperatures required for regeneration of CO?BOLs by as much as 76 °C. The lower regeneration temperatures realized with this polarity change allow for reduced solvent attrition and thermal degradation. Furthermore, the polarity assist shows considerable promise for reducing regeneration energy of CO?BOL solvents, and separation of the CO?BOL from the antisolvent is as simple as cooling the mixture below the upper critical solution temperature. Vapour-liquid equilibrium and liquid-liquid equilibrium measurements of a candidate CO?BOL with CO? with and without an antisolvent were completed. From this data, we present the evidence and impacts of a polarity change on a CO?BOL. Thermodynamic models and analysis of the system were constructed using ASPEN Plus, and forecasts preliminary process configurations and feasibility are also presented. Lastly, projections of solvent performance for removing CO? from a sub-critical coal fired power plant (total net power and parasitic load) are presented with and without this polarity assist and compared to DOE’s Case 10 MEA baseline.

  16. Stiffening solids with liquid inclusions

    E-Print Network [OSTI]

    Robert W. Style; Rostislav Boltyanskiy; Benjamin Allen; Katharine E. Jensen; Henry P. Foote; John S. Wettlaufer; Eric R. Dufresne

    2014-07-24T23:59:59.000Z

    From bone and wood to concrete and carbon fibre, composites are ubiquitous natural and engineering materials. Eshelby's inclusion theory describes how macroscopic stress fields couple to isolated microscopic inclusions, allowing prediction of a composite's bulk mechanical properties from a knowledge of its microstructure. It has been extended to describe a wide variety of phenomena from solid fracture to cell adhesion. Here, we show experimentally and theoretically that Eshelby's theory breaks down for small liquid inclusions in a soft solid. In this limit, an isolated droplet's deformation is strongly size-dependent with the smallest droplets mimicking the behaviour of solid inclusions. Furthermore, in opposition to the predictions of conventional composite theory, we find that finite concentrations of small liquid inclusions enhance the stiffness of soft solids. A straight-forward extension of Eshelby's theory, accounting for the surface tension of the solid-liquid interface, explains our experimental observations. The counterintuitive effect of liquid-stiffening of solids is expected whenever droplet radii are smaller than an elastocapillary length, given by the ratio of the surface tension to Young's modulus of the solid matrix.

  17. Liquid-film electron stripper

    DOE Patents [OSTI]

    Gavin, Basil F. (Albion, CA)

    1986-01-01T23:59:59.000Z

    An improved liquid-film electron stripper particularly for high intensity heavy ion beams which produces constant regenerated, stable, free-standing liquid films having an adjustable thickness between 0.3 to 0.05 microns. The improved electron stripper is basically composed of at least one high speed, rotating disc with a very sharp, precision-like, ground edge on one said of the disc's periphery and with a highly polished, flat, radial surface adjacent the sharp edge. A fine stream of liquid, such as oil, impinges at a 90.degree. angle adjacent the disc's sharp outer edge. Film terminators, located at a selected distance from the disc perimeter are positioned approximately perpendicular to the film. The terminators support, shape, and stretch the film and are arranged to assist in the prevention of liquid droplet formation by directing the collected film to a reservoir below without breaking or interfering with the film. One embodiment utilizes two rotating discs and associated terminators, with the discs rotating so as to form films in opposite directions, and with the second disc being located down beam-line relative to the first disc.

  18. Can hedge funds time market liquidity?

    E-Print Network [OSTI]

    Cao, Charles

    We explore a new dimension of fund managers' timing ability by examining whether they can time market liquidity through adjusting their portfolios' market exposure as aggregate liquidity conditions change. Using a large ...

  19. Mixing in a liquid metal electrode

    E-Print Network [OSTI]

    Kelley, Douglas H.

    Fluid mixing has first-order importance for many engineering problems in mass transport, including design and optimization of liquid-phase energy storage devices. Liquid metal batteries are currently being commercialized ...

  20. ELECTRONS ON THE SURFACE OF LIQUID HELIUM

    E-Print Network [OSTI]

    Lambert, David Kay

    2011-01-01T23:59:59.000Z

    ON THE SURFACE OF LIQUID HELIUM David Kay Lambert (Ph. D.ON THE SURFACE OF LIQUID HELIUM David Kay Lambert Materialsthe potential well near a helium surface, The charge density

  1. MUSHROOM WASTE MANAGEMENT PROJECT LIQUID WASTE MANAGEMENT

    E-Print Network [OSTI]

    of solid and liquid wastes generated at mushroom producing facilities. Environmental guidelines#12;MUSHROOM WASTE MANAGEMENT PROJECT LIQUID WASTE MANAGEMENT PHASE I: AUDIT OF CURRENT PRACTICE The Mushroom Waste Management Project (MWMP) was initiated by Environment Canada, the BC Ministry

  2. Spinful fermionic ladders at incommensurate filling: Phase diagram, local perturbations, and ionic potentials

    SciTech Connect (OSTI)

    Carr, Sam T., E-mail: S.T.Carr@kent.ac.uk [School of Physical Sciences, University of Kent, Canterbury CT2 7NH (United Kingdom); Institut für Theorie der Kondensierten Materie, Karlsruher Institut für Technologie, 76128 Karlsruhe (Germany); DFG Center for Functional Nanostructures, Karlsruher Institut für Technologie, 76128 Karlsruhe (Germany); Narozhny, Boris N. [Institut für Theorie der Kondensierten Materie, Karlsruher Institut für Technologie, 76128 Karlsruhe (Germany) [Institut für Theorie der Kondensierten Materie, Karlsruher Institut für Technologie, 76128 Karlsruhe (Germany); DFG Center for Functional Nanostructures, Karlsruher Institut für Technologie, 76128 Karlsruhe (Germany); Nersesyan, Alexander A. [The Abdus Salam International Centre for Theoretical Physics, 34100, Trieste (Italy)] [The Abdus Salam International Centre for Theoretical Physics, 34100, Trieste (Italy)

    2013-12-15T23:59:59.000Z

    We study the effect of external potential on transport properties of the fermionic two-leg ladder model. The response of the system to a local perturbation is strongly dependent on the ground state properties of the system and especially on the dominant correlations. We categorize all phases and transitions in the model (for incommensurate filling) and introduce “hopping-driven transitions” that the system undergoes as the inter-chain hopping is increased from zero. We also describe the response of the system to an ionic potential. The physics of this effect is similar to that of the single impurity, except that the ionic potential can affect the bulk properties of the system and in particular induce true long range order. -- Highlights: •We study low temperature electronic properties of a two leg ladder. •We find a wide variety of phase transitions as a function of model parameters. •We study the effect of impurities on these models. •Conductance may be very sensitive to the structure of these impurities.

  3. Establishing Dual Electrogenerated Chemiluminescence and Multi-Color Electrochromism in Functional Ionic Transition Metal Complexes

    SciTech Connect (OSTI)

    Puodziukynaite, Egle; Oberst, Justin L.; Dyer, Aubrey L.; Reynolds, John R.

    2012-01-01T23:59:59.000Z

    A combination of electrochromism and electroluminescence in functional materials could lead to single-layer dual electrochromic/electroluminescent (EC/EL) display devices, capable of simultaneous operation in emissive and reflective modes. Whereas such next generation displays could provide optimal visibility in any ambient lighting situation, materials available that exhibit such characteristics in the active layer are limited due to the required intrinsic multifunctionality (i.e., redox activity, electroluminescence, electrochromism, and ion conductivity) and to date can only be achieved via the rational design of ionic transition-metal complexes. Reported herein is the synthesis and characterization of a new family of acrylate-containing ruthenium (tris)bipyridine-based coordination complexes with multifunctional characteristics. Potential use of the presented compounds in EC/EL devices is established, as they are applied as cross-linked electrochromic films and electrochemiluminescent layers in light-emitting electrochemical cell devices. Electrochromic switching of the polymeric networks between yellow, orange, green, brown and transmissive states is demonstrated, and electrochemiluminescent devices based on the complexes synthesized show red-orange to deep red emission with ?{sub max} ranging from 680 to 722 nm and luminance up to 135 cd/m{sup 2}. Additionally, a dual EC/EL device prototype is presented where light emission and multicolor electrochromism occur from the same pixel comprised of a single active layer, demonstrating a true combination of these properties in ionic transition-metal complexes.

  4. Role of the dielectric constant of ferroelectric ceramic in enhancing the ionic conductivity of a polymer electrolyte composite

    E-Print Network [OSTI]

    Pramod Kumar Singh; Amreesh Chandra

    2003-04-21T23:59:59.000Z

    The dispersal of high dielectric constant ferroelectric ceramic material Ba(0.7)Sr(0.3)TiO(3) (Tc~30 C) and Ba(0.88)Sr(0.12)TiO(3) (Tc~90 C) in an ion conducting polymer electrolyte (PEO:NH4I) is reported to result in an increase in the room temperature ionic conductivity by two orders of magnitude. The conductivity enhancememt "peaks" as we approach the dielectric phase transition of the dispersed ferroelectric material where the dielectric constant changes from ~ 2000 to 4000. This establishes the role of dielectric constant of the dispersoid in enhancing the ionic conductivity of the polymeric composites.

  5. Electrolyte Solvation and Ionic Association. V. Acetonitrile-Lithium Bis(fluorosulfonyl)imide (LiFSI) Mixtures

    SciTech Connect (OSTI)

    Han, Sang D.; Borodin, Oleg; Seo, D. M.; Zhou, Zhi B.; Henderson, Wesley A.

    2014-09-30T23:59:59.000Z

    Electrolytes with the salt lithium bis(fluorosulfonyl)imide (LiFSI) have been evaluated relative to comparable electrolytes with other lithium salts. Acetonitrile (AN) has been used as a model electrolyte solvent. The information obtained from the thermal phase behavior, solvation/ionic association interactions, quantum chemical (QC) calculations and molecular dynamics (MD) simulations (with an APPLE&P many-body polarizable force field for the LiFSI salt) of the (AN)n-LiFSI mixtures provides detailed insight into the coordination interactions of the FSI- anions and the wide variability noted in the electrolyte transport property (i.e., viscosity and ionic conductivity).

  6. Method to detect the end-point for PCR DNA amplification using an ionically labeled probe and measuring impedance change

    DOE Patents [OSTI]

    Miles, Robin R. (Danville, CA); Belgrader, Phillip (Severna Park, MD); Fuller, Christopher D. (Oakland, CA)

    2007-01-02T23:59:59.000Z

    Impedance measurements are used to detect the end-point for PCR DNA amplification. A pair of spaced electrodes are located on a surface of a microfluidic channel and an AC or DC voltage is applied across the electrodes to produce an electric field. An ionically labeled probe will attach to a complementary DNA segment, and a polymerase enzyme will release the ionic label. This causes the conductivity of the solution in the area of the electrode to change. This change in conductivity is measured as a change in the impedance been the two electrodes.

  7. Influence of Ionic Surfactants on the Aggregation of Poly(Ethylene Oxide)-Poly(Propylene Oxide)-Poly(Ethylene Oxide) Block Copolymers Studied by Differential Scanning and

    E-Print Network [OSTI]

    Loh, Watson

    Influence of Ionic Surfactants on the Aggregation of Poly(Ethylene Oxide)-Poly(Propylene Oxide copolymers of poly(ethylene oxide) and poly(propylene oxide), EOnPOmEOn, and the ionic surfactants sodium the aggregates of all three polymers. Introduction Water-soluble poly(ethylene oxide)-poly(propylene oxide)- poly

  8. Method for enhanced atomization of liquids

    DOE Patents [OSTI]

    Thompson, Richard E. (27121 Puerta del Oro, Mission Viejo, CA 92691); White, Jerome R. (44755 Wyandotte, Hemet, CA 92544)

    1993-01-01T23:59:59.000Z

    In a process for atomizing a slurry or liquid process stream in which a slurry or liquid is passed through a nozzle to provide a primary atomized process stream, an improvement which comprises subjecting the liquid or slurry process stream to microwave energy as the liquid or slurry process stream exits the nozzle, wherein sufficient microwave heating is provided to flash vaporize the primary atomized process stream.

  9. Heterophase liquid states: Thermodynamics, structure, dynamics

    E-Print Network [OSTI]

    A. S. Bakai

    2015-01-12T23:59:59.000Z

    An overview of theoretical results and experimental data on the thermodynamics, structure and dynamics of the heterophase glass-forming liquids is presented. The theoretical approach is based on the mesoscopic heterophase fluctuations model (HPFM) developed within the framework of the bounded partition function approach. The Fischer cluster phenomenon, glass transition, liquid-liquid transformations, parametric phase diagram, cooperative dynamics and fragility of the glass-forming liquids is considered.

  10. Cooperative motions in supercooled liquids and glasses

    E-Print Network [OSTI]

    Stevenson, Jacob D.

    2009-01-01T23:59:59.000Z

    P. Heat capacity and entropy of an equilibrium liquid fromliquids should correlate inversely with the con?gurational heat capacity,

  11. Response functions near the liquid-liquid critical point of ST2 water

    E-Print Network [OSTI]

    Stanley, H. Eugene

    speci¿c heat capacity CP and the isothermal compressibility KT . We use two different methods: (i) fromResponse functions near the liquid-liquid critical point of ST2 water Erik Lascaris , T. A, and for four different system sizes, N = 63, 73, 83, and 93. We locate the liquid-liquid phase transition line

  12. Erasing no-man's land by thermodynamically stabilizing the liquid-liquid transition in tetrahedral particles

    E-Print Network [OSTI]

    Loss, Daniel

    compressibility KT and the isobaric heat capacity CP . In the LLCP hypothesis, the density anomalies of waterErasing no-man's land by thermodynamically stabilizing the liquid-liquid transition in tetrahedral, Sapienza, Universit´a di Roma, Piazzale Aldo Moro 2, I-00185, Roma, Italy. EFFECTS OF THE LIQUID-LIQUID

  13. Apparatus and method for spraying liquid materials

    DOE Patents [OSTI]

    Alvarez, J.L.; Watson, L.D.

    1988-01-21T23:59:59.000Z

    A method for spraying liquids involving a flow of gas which shears the liquid. A flow of gas is introduced in a converging-diverging nozzle where it meets and shears the liquid into small particles which are of a size and uniformity which can be controlled through adjustment of pressures and gas velocity. 5 figs.

  14. Liquid Transportation Fuels from Coal and Biomass

    E-Print Network [OSTI]

    Liquid Transportation Fuels from Coal and Biomass Technological Status, Costs, and Environmental for liquid fuels produced from coal or biomass. · Evaluate environmental, economic, policy, and social Impacts Panel on Alternative Liquid Transportation Fuels DOE LDV Workshop 7-26-10 Mike Ramage and Jim

  15. Computation of liquid-liquid equilibrium in multicomponent electrolyte systems

    SciTech Connect (OSTI)

    Vianna, R.F.; d`Avila, S.G. [Universidade Estadual de Campinas (Brazil)

    1996-12-31T23:59:59.000Z

    A computational algorithm for predicting liquid-liquid equilibrium (LLE) data, based on a generalization of the maximum likelihood method applied to implicit constraints, is presented. The algorithm accepts multicomponent data and binary interaction parameters. A comparative study of the models NRTL and electrolyte-NRTL, used for estimating activity coefficients in a quaternary electrolyte system, is presented and discussed. Results show that both models give accurate predictions and the algorithm presents a good performance without convergence or initialization problems. This suggests that the basic NRTL model can be used for describing phase behavior in weak electrolyte systems and the procedure can be of great use for design and optimization of processes involving multicomponent electrolyte systems. 9 refs., 1 fig., 1 tab.

  16. Liquid Propane Injection Technology Conductive to Today's North...

    Office of Energy Efficiency and Renewable Energy (EERE) Indexed Site

    Technology Conductive to Today's North American Specification Liquid Propane Injection Technology Conductive to Today's North American Specification Liquid propane injection...

  17. Liquid Nitrogen Ice Cream (1st Grade) Lesson Plan

    E-Print Network [OSTI]

    . Introduce kids to liquid nitrogen. Explain that it is a liquid and is very cold (kids will be excited

  18. High pressure liquid level monitor

    DOE Patents [OSTI]

    Bean, Vern E. (Frederick, MD); Long, Frederick G. (Ijamsville, MD)

    1984-01-01T23:59:59.000Z

    A liquid level monitor for tracking the level of a coal slurry in a high-pressure vessel including a toroidal-shaped float with magnetically permeable bands thereon disposed within the vessel, two pairs of magnetic field generators and detectors disposed outside the vessel adjacent the top and bottom thereof and magnetically coupled to the magnetically permeable bands on the float, and signal processing circuitry for combining signals from the top and bottom detectors for generating a monotonically increasing analog control signal which is a function of liquid level. The control signal may be utilized to operate high-pressure control valves associated with processes in which the high-pressure vessel is used.

  19. Alien liquid detector and control

    SciTech Connect (OSTI)

    Potter, B.M.

    1980-09-02T23:59:59.000Z

    An alien liquid detector employs a monitoring element and an energizing circuit for maintaining the temperature of the monitoring element substantially above ambient temperature. For this purpose an electronic circit controls a flow of heating current to the monitoring element. The presence of an alien liquid is detected by sensing a predetermined change in heating current flow to the monitoring element, e.g., to distinguish between water and oil. In preferred embodiments the monitoring element is a thermistor whose resistance is compared with a reference resistance and heating current through the thermistor is controlled in accordance with the difference. In one embodiment a bridge circuit senses the resistance difference; the difference may be sensed by an operational amplifier arrangement. Features of the invention include positioning the monitoring element at the surface of water, slightly immersed, so that the power required to maintain the thermistor temperature substantially above ambient temperature serves to detect presence of oil pollution at the surface.

  20. Plasma-Surface Interactions on Liquids

    SciTech Connect (OSTI)

    R. Bastasz; W. Eckstein

    2000-05-01T23:59:59.000Z

    Liquid plasma-facing surfaces have been suggested as an option for advanced fusion devices, particularly in regions where solid materials may not survive over long operating periods. Because liquid surfaces can be replenished, they offer the possibility of tolerating intense particle bombardment and of recovering from off-normal events. As a preliminary step in understanding the nature of plasma-surface interactions on liquids, the authors consider some of the surface processes occurring in liquids undergoing irradiation by energetic particles. These include (1) sputtering, (2) segregation of liquid component species and impurities, (3) evaporation, and (4) trapping and release of incident particles. Aspects of these processes are examined for several candidate liquids, which represent three types of low-Z liquids: pure metals (Li), metallic alloys (Sn-Li), and compound insulators (Li{sub 2}BeF{sub 4}).