WorldWideScience

Sample records for metalorganic vapour phase

  1. Recent developments in metalorganic precursors for metalorganic chemical vapour deposition

    Science.gov (United States)

    Jones, A. C.; Rushworth, S. A.; Auld, J.

    1995-01-01

    Volatile metalorganic compounds are finding an increasing application in the deposition of metals and semiconductors by metalorganic chemical vapour deposition (MOCVD). In this paper, the use of some new precursor systems in the growth of selected metals and alloys is reviewed with emphasis being placed on precursor chemistry in the gas phase and at the growth surface.

  2. X-ray and transmission electron microscopy characterization of twinned CdO thin films grown on a-plane sapphire by metalorganic vapour phase epitaxy

    Energy Technology Data Exchange (ETDEWEB)

    Martinez-Tomas, M.C.; Zuniga-Perez, J.; Munoz-Sanjose, V. [Departament de Fisica Aplicada i Electromagnetisme, Valencia (Spain); Vennegues, P.; Tottereau, O. [Centre National de la Recherche Scientifique, Centre de Recherche sur l' Hetero-Epitaxie et ses Applications, Valbonne (France)

    2007-07-15

    In the frame of studying II-VI oxides of interest in optoelectronic technologies, the structural properties of CdO films grown by metalorganic vapour phase epitaxy on a-plane sapphire substrates have been analysed. The study has been performed by means of X-ray diffraction and cross-sectional transmission electron microscopy measurements. CdO films have been found to grow along [111] with the presence of twinned domains. Asymmetrical reflections have been used to study the crystalline quality of the twinned domains, independent of each other, as well as to determine their relative population. The analysis has been made as a function of growth conditions: VI/II precursors molar ratio and growth temperature. (orig.)

  3. X-ray and transmission electron microscopy characterization of twinned CdO thin films grown on a-plane sapphire by metalorganic vapour phase epitaxy

    International Nuclear Information System (INIS)

    Martinez-Tomas, M.C.; Zuniga-Perez, J.; Munoz-Sanjose, V.; Vennegues, P.; Tottereau, O.

    2007-01-01

    In the frame of studying II-VI oxides of interest in optoelectronic technologies, the structural properties of CdO films grown by metalorganic vapour phase epitaxy on a-plane sapphire substrates have been analysed. The study has been performed by means of X-ray diffraction and cross-sectional transmission electron microscopy measurements. CdO films have been found to grow along [111] with the presence of twinned domains. Asymmetrical reflections have been used to study the crystalline quality of the twinned domains, independent of each other, as well as to determine their relative population. The analysis has been made as a function of growth conditions: VI/II precursors molar ratio and growth temperature. (orig.)

  4. X-ray characterization of CdO thin films grown on a-, c-, r- and m-plane sapphire by metalorganic vapour phase-epitaxy

    Energy Technology Data Exchange (ETDEWEB)

    Zuniga-Perez, J.; Martinez-Tomas, C.; Munoz-Sanjose, V. [Departamento de Fisica Aplicada y Electromagnetismo, Universitat de Valencia, C/Dr. Moliner 50, 46100 Burjassot (Spain)

    2005-02-01

    CdO thin films have been grown on a-plane (11 anti 20), c-plane (0001), r-plane (01 anti 12) and m-plane (10 anti 10) sapphire substrates by metalorganic vapour-phase epitaxy (MOVPE). The effects of different substrate orientations on the structural properties of the films have been analyzed by means of X-ray diffraction, including {theta}-2{theta} scans, pole figures and rocking curves. (111), (001) and (110) orientations are found on a-, r-, and m-sapphire respectively, while films deposited on c-plane exhibit an orientation in which no low-index crystal plane is parallel to the sample surface. The recorded pole figures have allowed determining the epitaxial relationships between films and substrates, as well as the presence or absence of extended defects. The rocking curves indicate that high quality thin films, in terms of tilt and twist, can be obtained on r-, c- and m-plane sapphire, while further improvement is needed over the a-orientation. (copyright 2005 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  5. Properties of alumina films by atmospheric pressure metal-organic chemical vapour deposition

    NARCIS (Netherlands)

    Haanappel, V.A.C.; Haanappel, V.A.C.; van Corbach, H.D.; Fransen, T.; Gellings, P.J.

    1994-01-01

    Thin alumina films were deposited at low temperatures (290–420°C) on stainless steel, type AISI 304. The deposition process was carried out in nitrogen by metal-organic chemical vapour deposition using aluminum tri-sec-butoxide. The film properties including the protection of the underlying

  6. The mechanical properties of thin alumina film deposited by metal-organic chemical vapour deposition

    NARCIS (Netherlands)

    Haanappel, V.A.C.; Haanappel, V.A.C.; Gellings, P.J.; van de Vendel, D.; Metselaar, H.S.C.; van Corbach, H.D.; Fransen, T.

    1995-01-01

    Amorphous alumina films were deposited by metal-organic chemical vapour deposition (MOCVD) on stainless steel, type AISI 304. The MOCVD experiments were performed in nitrogen at low and atmospheric pressures. The effects of deposition temperature, growth rate and film thickness on the mechanical

  7. A novel three-jet microreactor for localized metal-organic chemical vapour deposition of gallium arsenide : Design and simulation

    NARCIS (Netherlands)

    Konakov, S.A.; Krzhizhanovskaya, V.V.

    2016-01-01

    We present a novel three-jet microreactor design for localized deposition of gallium arsenide (GaAs) by low-pressure Metal-Organic Chemical Vapour Deposition (MOCVD) for semiconductor devices, microelectronics and solar cells. Our approach is advantageous compared to the standard lithography and

  8. Properties of alumina films prepared by metal-organic chemical vapour deposition at atmospheric pressure in hte presence of small amounts of water

    NARCIS (Netherlands)

    Haanappel, V.A.C.; Haanappel, V.A.C.; van Corbach, H.D.; Rem, J.B.; Fransen, T.; Gellings, P.J.

    1995-01-01

    Thin alumina films were deposited on stainless steel, type AISI 304. The deposition process was carried out in nitrogen with low partial pressures of water (0–2.6 × 10−2 kPa (0−0.20 mmHg)) by metal-organic chemical vapour deposition (MOCVD) with aluminium-tri-sec-butoxide (ATSB) as the precursor.

  9. Temperature-dependent Hall effect studies of ZnO thin films grown by metalorganic chemical vapour deposition

    International Nuclear Information System (INIS)

    Roro, K T; Dangbegnon, J K; Sivaraya, S; Westraadt, J E; Neethling, J H; Leitch, A W R; Botha, J R; Kassier, G H

    2008-01-01

    The electrical properties of zinc oxide (ZnO) thin films of various thicknesses (0.3–4.4 µm) grown by metalorganic chemical vapour deposition on glass substrates have been studied by using temperature-dependent Hall-effect (TDH) measurements in the 18–300 K range. The high quality of the layers has been confirmed with x-ray diffraction, transmission electron microscopy, scanning electron microscopy and photoluminescence techniques. TDH measurements indicate the presence of a degenerate layer which significantly influences the low-temperature data. It is found that the measured mobility generally increases with increasing layer thickness, reaching a value of 120 cm 2 V −1 s −1 at room temperature for the 4.4 µm thick sample. The lateral grain size of the layers is also found to increase with thickness indicating a clear correlation between the size of the surface grains and the electrical properties of corresponding films. Theoretical fits to the Hall data suggest that the bulk conduction of the layers is dominated by a weakly compensated donor with activation energy in the 33–41 meV range and concentration of the order of 10 17 cm −3 , as well as a total acceptor concentration of mid-10 15 cm −3 . Grain boundary scattering is found to be an important limiting factor of the mobility throughout the temperature range considered

  10. Gas/vapour separation using ultra-microporous metal-organic frameworks: insights into the structure/separation relationship.

    Science.gov (United States)

    Adil, Karim; Belmabkhout, Youssef; Pillai, Renjith S; Cadiau, Amandine; Bhatt, Prashant M; Assen, Ayalew H; Maurin, Guillaume; Eddaoudi, Mohamed

    2017-06-06

    The separation of related molecules with similar physical/chemical properties is of prime industrial importance and practically entails a substantial energy penalty, typically necessitating the operation of energy-demanding low temperature fractional distillation techniques. Certainly research efforts, in academia and industry alike, are ongoing with the main aim to develop advanced functional porous materials to be adopted as adsorbents for the effective and energy-efficient separation of various important commodities. Of special interest is the subclass of metal-organic frameworks (MOFs) with pore aperture sizes below 5-7 Å, namely ultra-microporous MOFs, which in contrast to conventional zeolites and activated carbons show great prospects for addressing key challenges in separations pertaining to energy and environmental sustainability, specifically materials for carbon capture and separation of olefin/paraffin, acetylene/ethylene, linear/branched alkanes, xenon/krypton, etc. In this tutorial review we discuss the latest developments in ultra-microporous MOF adsorbents and their use as separating agents via thermodynamics and/or kinetics and molecular sieving. Appreciably, we provide insights into the distinct microscopic mechanisms governing the resultant separation performances, and suggest a plausible correlation between the inherent structural features/topology of MOFs and the associated gas/vapour separation performance.

  11. Growth of AlGaSb Compound Semiconductors on GaAs Substrate by Metalorganic Chemical Vapour Deposition

    Directory of Open Access Journals (Sweden)

    A. H. Ramelan

    2010-01-01

    Full Text Available Epitaxial AlxGa1-xSb layers on GaAs substrate have been grown by atmospheric pressure metalorganic chemical vapour deposition using TMAl, TMGa, and TMSb. We report the effect of V/III flux ratio and growth temperature on growth rate, surface morphology, electrical properties, and composition analysis. A growth rate activation energy of 0.73 eV was found. For layers grown on GaAs at 580∘C and 600∘C with a V/III ratio of 3 a high quality surface morphology is typical, with a mirror-like surface and good composition control. It was found that a suitable growth temperature and V/III flux ratio was beneficial for producing good AlGaSb layers. Undoped AlGaSb grown at 580∘C with a V/III flux ratio of 3 at the rate of 3.5 μm/hour shows p-type conductivity with smooth surface morphology and its hole mobility and carrier concentration are equal to 237 cm2/V.s and 4.6 × 1017 cm-3, respectively, at 77 K. The net hole concentration of unintentionally doped AlGaSb was found to be significantly decreased with the increased of aluminium concentration. All samples investigated show oxide layers (Al2O3, Sb2O3, and Ga2O5 on their surfaces. In particular the percentage of aluminium-oxide was very high compared with a small percentage of AlSb. Carbon content on the surface was also very high.

  12. Characterization of TiO2 thin films obtained by metal-organic chemical vapour deposition

    International Nuclear Information System (INIS)

    Carriel, Rodrigo Crociati

    2015-01-01

    Titanium dioxide (TiO 2 ) thin films were grown on silicon substrate (100) by MOCVD process (chemical deposition of organometallic vapor phase). The films were grown at 400, 500, 600 and 700 ° C in a conventional horizontal equipment. Titanium tetraisopropoxide was used as source of both oxygen and titanium. Nitrogen was used as carrier and purge gas. X-ray diffraction technique was used for the characterization of the crystalline structure. Scanning electron microscopy with field emission gun was used to evaluate the morphology and thickness of the films. The films grown at 400 and 500°C presented anatase phase. The film grown at 600ºC presented rutile besides anatase phase, while the film grown at 700°C showed, in addition to anatase and rutile, brookite phase. In order to evaluate the electrochemical behavior of the films cyclic voltammetry technique was used. The tests revealed that the TiO2 films formed exclusively by the anatase phase exhibit strong capacitive character. The anodic current peak is directly proportional to the square root of the scanning rate for films grown at 500ºC, suggesting that linear diffusion is the predominant mechanism of cations transport. It was observed that in the film grown during 60 minutes the Na+ ions intercalation and deintercalation easily. The films grown in the other conditions did not present the anodic current peak, although charge was accumulated in the film. (author)

  13. A static analytical apparatus for vapour pressures and (vapour + liquid) phase equilibrium measurements with an internal stirrer and view windows

    International Nuclear Information System (INIS)

    Guo, Hao; Gong, Maoqiong; Dong, Xueqiang; Wu, Jianfeng

    2014-01-01

    Highlights: • A new static analytical apparatus for vapour pressures and VLE data was designed. • The {R600a + R245fa} system was selected as a verification system. • Correlation of VLE data was made using PRvdWs and PRHVNRTL model. • Good agreement can be found with the literature data. - Abstract: A new static analytical apparatus for reliable vapour pressures and (vapour + liquid) equilibrium data of small-scale cell (≈150 mL) with internal stirrer and view windows was designed. In this work, the compositions of the phases were analyzed by a gas chromatograph connected on-line with TCD detectors. The operating pressure ranges from (0 to 3000) kPa, and the operating temperature range from (293 to 400) K. Phase equilibrium data for previously reported systems were first measured to test the credibility of the newly developed apparatus. The test included vapour pressure of 1,1,1,3,3-pentafluoropropane (R245fa) and isobutane (R600a), VLE of the (R600a + R245fa) system from T = (293.150 to 343.880) K. The measured VLE data are regressed with thermodynamic models using Peng–Robinson EoS with two different models, viz. the van der Waals mixing rule, and the Huron–Vidal mixing rule utilising the non-random two-liquid activity coefficient model. Thermodynamic consistency testing is also performed for the newly measured experimental data

  14. Demonstration of GaN/InGaN Light Emitting Diodes on (100) β-Ga2O3 Substrates by Metalorganic Chemical Vapour Deposition

    International Nuclear Information System (INIS)

    Zi-Li, Xie; Rong, Zhang; Xiang-Qian, Xiu; Ping, Han; Bin, Liu; Hong, Zhao; Ruo-Lian, Jiang; Yi, Shi; You-Dou, Zheng; Chang-Tai, Xia

    2008-01-01

    The growth and fabrication of GaN/InGaN multiple quantum well (MQW) light emitting diodes (LEDs) on (100) β-Ga 2 O 3 single crystal substrates by metal-organic chemical vapour deposition (MOCVD) technique are reported. x-ray diffraction (XRD) θ – 2θ scan spectroscopy is carried out on the GaN buffer layer grown on a (100) β-Ga 2 O 3 substrate. The spectrum presents several sharp peaks corresponding to the (100) β-Ga 2 O 3 and (004) GaN. High-quality (0002) GaN material is obtained. The emission characteristics of the GaN/InGaN MQW LED are measurement. The first green LED on β-Ga 2 O 3 with vertical current injection is demonstrated. (condensed matter: electronic structure, electrical, magnetic, and optical properties)

  15. High-internal-phase emulsions stabilized by metal-organic frameworks and derivation of ultralight metal-organic aerogels

    Science.gov (United States)

    Zhang, Bingxing; Zhang, Jianling; Liu, Chengcheng; Peng, Li; Sang, Xinxin; Han, Buxing; Ma, Xue; Luo, Tian; Tan, Xiuniang; Yang, Guanying

    2016-02-01

    To design high-internal-phase emulsion (HIPE) systems is of great interest from the viewpoints of both fundamental researches and practical applications. Here we demonstrate for the first time the utilization of metal-organic framework (MOF) for HIPE formation. By stirring the mixture of water, oil and MOF at room temperature, the HIPE stabilized by the assembly of MOF nanocrystals at oil-water interface could be formed. The MOF-stabilized HIPE provides a novel route to produce highly porous metal-organic aerogel (MOA) monolith. After removing the liquids from the MOF-stabilized HIPE, the ultralight MOA with density as low as 0.01 g·cm-3 was obtained. The HIPE approach for MOA formation has unique advantages and is versatile in producing different kinds of ultralight MOAs with tunable porosities and structures.

  16. Corrosion resistant coatings (Al@#2@#O@#3@#) produced by metal-organic chemical vapour deposition using ATSB

    NARCIS (Netherlands)

    Haanappel, V.A.C.; Haanappel, V.A.C.; van Corbach, H.D.; Fransen, T.; Gellings, P.J.

    1993-01-01

    The metal organic chemical vapour deposition (MOCVD) of amorphous alumina films on steel was performed in nitrogen at atmospheric pressure. This MOCVD process is based on the thermal decomposition of aluminium-tri-sec-butoxide (ATSB). The effect of the deposition temperature (within the range

  17. Crystal growth of an organic non-linear optical material from the vapour phase

    International Nuclear Information System (INIS)

    Hou, W.

    1999-01-01

    Due to the potential applications of organic non-linear optical materials in the areas of optical processing and communication, the investigation of the crystal growth of new organic NLO materials has been an active field for the last 20 years. For such uses it is necessary to produce single crystals of high quality and perfection, free of strain and defects. When crystals are grown from the solution and the melt, solvent and the decomposition component in the melt can introduce impurities and imperfection to the as-grown crystals. For crystals grown from vapour phase, in the absence of the solvent, this cannot occur and the method promises to yield single crystals of higher quality. Despite this attraction, little attention has been paid to the vapour phase growth of organic NLO crystals. It was with this in mind that the following investigation was carried out. Using Methyl p-hydroxybenzoate (p-MHB), a potential organic NLO material, a comparison investigation was made of its crystal growth from both the vapour phase and solution; this included an examination of morphological assessment, structural perfection, surface morphology and growth kinetics of the as-grown crystals and the mass transport properties in the growth ampoule. Collation of this data allows the definition of the best conditions for vapour phase growth to produce specimens of high quality and purity. (author)

  18. Metal-organic chemical vapour deposition of lithium manganese oxide thin films via single solid source precursor

    Directory of Open Access Journals (Sweden)

    Oyedotun K.O.

    2015-12-01

    Full Text Available Lithium manganese oxide thin films were deposited on sodalime glass substrates by metal organic chemical vapour deposition (MOCVD technique. The films were prepared by pyrolysis of lithium manganese acetylacetonate precursor at a temperature of 420 °C with a flow rate of 2.5 dm3/min for two-hour deposition period. Rutherford backscattering spectroscopy (RBS, UV-Vis spectrophotometry, X-ray diffraction (XRD spectroscopy, atomic force microscopy (AFM and van der Pauw four point probe method were used for characterizations of the film samples. RBS studies of the films revealed fair thickness of 1112.311 (1015 atoms/cm2 and effective stoichiometric relationship of Li0.47Mn0.27O0.26. The films exhibited relatively high transmission (50 % T in the visible and NIR range, with the bandgap energy of 2.55 eV. Broad and diffused X-ray diffraction patterns obtained showed that the film was amorphous in nature, while microstructural studies indicated dense and uniformly distributed layer across the substrate. Resistivity value of 4.9 Ω·cm was obtained for the thin film. Compared with Mn0.2O0.8 thin film, a significant lattice absorption edge shift was observed in the Li0.47Mn0.27O0.26 film.

  19. Growth and properties of Al-rich InxAl1-xN ternary alloy grown on GaN template by metalorganic chemical vapour deposition

    International Nuclear Information System (INIS)

    Oh, Tae Su; Suh, Eun-Kyung; Kim, Jong Ock; Jeong, Hyun; Lee, Yong Seok; Nagarajan, S; Lim, Kee Young; Hong, Chang-Hee

    2008-01-01

    An Al-rich In x Al 1-x N ternary alloy was grown on a GaN template by metal-organic chemical vapour deposition (MOCVD). The GaN template was fabricated on a c-plane sapphire with a low temperature GaN nucleation layer. The growth of the 300 nm thick In x Al 1-x N layer was carried out under various growth temperatures and pressures. The surface morphology and the InN molar fraction of the In x Al 1-x N layer were assessed by using atomic force microscopy (AFM) and high resolution x-ray diffraction, respectively. The AFM surface images of the In x Al 1-x N ternary alloy exhibited quantum dot-like grains caused by the 3D island growth mode. The grains, however, disappeared rapidly by increasing diffusion length and mobility of the Al adatoms with increasing growth temperature and the full width at half maximum value of ternary peaks in HR-XRD decreased with decreasing growth pressure. The MOCVD growth condition with the increased growth temperature and decreased growth pressure would be effective to grow the In x Al 1-x N ternary alloy with a smooth surface and improved quality. The optical band edge of In x Al 1-x N ternary alloys was estimated by optical absorbance and, based on the results of HR-XRD and optical absorbance measurements, we obtained the bowing parameter of the In x Al 1-x N ternary alloy at b = 5.3 eV, which was slightly larger than that of previous reports

  20. Properties of meso-Erythritol; phase state, accommodation coefficient and saturation vapour pressure

    Science.gov (United States)

    Emanuelsson, Eva; Tschiskale, Morten; Bilde, Merete

    2016-04-01

    Introduction Saturation vapour pressure and the associated temperature dependence (enthalpy ΔH), are key parameters for improving predictive atmospheric models. Generally, the atmospheric aerosol community lack experimentally determined values of these properties for relevant organic aerosol compounds (Bilde et al., 2015). In this work we have studied the organic aerosol component meso-Erythritol. Methods Sub-micron airborne particles of meso-Erythritol were generated by nebulization from aqueous solution, dried, and a mono disperse fraction of the aerosol was selected using a differential mobility analyser. The particles were then allowed to evaporate in the ARAGORN (AaRhus Atmospheric Gas phase OR Nano particle) flow tube. It is a temperature controlled 3.5 m long stainless steel tube with an internal diameter of 0.026 m (Bilde et al., 2003, Zardini et al., 2010). Changes in particle size as function of evaporation time were determined using a scanning mobility particle sizer system. Physical properties like air flow, temperature, humidity and pressure were controlled and monitored on several places in the setup. The saturation vapour pressures were then inferred from the experimental results in the MATLAB® program AU_VaPCaP (Aarhus University_Vapour Pressure Calculation Program). Results Following evaporation, meso-Erythriol under some conditions showed a bimodal particle size distribution indicating the formation of particles of two different phase states. The issue of physical phase state, along with critical assumptions e.g. the accommodation coefficient in the calculations of saturation vapour pressures of atmospheric relevant compounds, will be discussed. Saturation vapour pressures from the organic compound meso-Erythritol will be presented at temperatures between 278 and 308 K, and results will be discussed in the context of atmospheric chemistry. References Bilde, M. et al., (2015), Chemical Reviews, 115 (10), 4115-4156. Bilde, M. et. al., (2003

  1. High Quality InAs/InSb nanowire heterostructrues grown by metalorganic vapour phase epitaxy

    DEFF Research Database (Denmark)

    Caroff, Philippe; Wagner, Jakob Birkedal; Dick, Kimberly A.

    2008-01-01

    Growth and structural analysis of epitaxial InAs/InSb nanowire heterostructures are demonstrated for the first time. InSb segments are found to be perfect crystals, free of stacking faults or other major defects, and have a sharp interface with InAs (see image). After growth the seed particle...... is a single crystal nearly lattice matched to the nanowire. InSb segments are n-type and form ohmic contacts with Ni/Au electrodes....

  2. Structural characterization of InN quantum dots grown by Metalorganic Vapour Phase Epitaxy

    Energy Technology Data Exchange (ETDEWEB)

    Lozano, J.G.; Gonzalez, D.; Sanchez, A.M.; Araujo, D.; Garcia, R. [Departamento de Ciencia de los Materiales e Ingenieria Metalurgica y Quimica Inorganica, Universidad de Cadiz, Apartado 40, Puerto Real, Cadiz (Spain); Ruffenach, S.; Briot, O. [Groupe d' Etude des Semiconducteurs, Universite Montpellier II, 34095 Montpellier (France)

    2006-06-15

    The effect of a low temperature GaN capping layer on the structural properties of InN quantum dots is reported. InN quantum dots grown onto sapphire using GaN buffer, with and without low temperature GaN capping layer, have been investigated by atomic force microscopy and transmission electron microscopy. The analysis revealed hexagonal shape quantum dots in both samples. Moreover, the GaN capping layer gives rise to a reduction in the dots aspect ratio. Moire fringe patterns, obtained in planar view geometry, were used to analyse the strain relaxation of the InN quantum dots. The Moire pattern measurements demonstrated that the uncapped InN quantum dot is almost fully relaxed. These results are related to the formation of a 60 misfit dislocation network in the InN/GaN interface. However, the capping layer not only generated a change of the aspect ratio, but also a decrease in the heterostructure plastic relaxation. The reason of this effect is discussed. (copyright 2006 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  3. Homochiral metal-organic framework used as a stationary phase for high-performance liquid chromatography.

    Science.gov (United States)

    Kong, Jiao; Zhang, Mei; Duan, Ai-Hong; Zhang, Jun-Hui; Yang, Rui; Yuan, Li-Ming

    2015-02-01

    Metal-organic frameworks are promising porous materials. Chiral metal-organic frameworks have attracted considerable attention in controlling enantioselectivity. In this study, a homochiral metal-organic framework [Co(2) (D-cam)(2) (TMDPy)] (D-cam = D-camphorates, TMDPy = 4,4'-trimethylenedipyridine) with a non-interpenetrating primitive cubic net has been used as a chiral stationary phase in high-performance liquid chromatography. It has allowed the successful separation of six positional isomers and six chiral compounds. The good selectivity and baseline separation, or at least 60% valley separation, confirmed its excellent molecular recognition characteristics. The relative standard deviations for the retention time of run-to-run and column-to-column were less than 1.8 and 3.1%, respectively. These results demonstrate that [Co(2) (D-cam)(2) (TMDPy)] may represent a promising chiral stationary phase for use in high-performance liquid chromatography. © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  4. Zinc-induced lattice contraction in metalorganic vapor phase epitaxy grown AlGaInP

    International Nuclear Information System (INIS)

    Li, Xinyi; Zhang, Jianqin; Zhang, Wei; Lu, Hongbo; Zhou, Dayong

    2015-01-01

    p-Type Zn doped (Al x Ga 1-x ) 0.5 In 0.5 P layers have been grown on (001) GaAs substrates by metalorganic vapor phase epitaxy. The lattice constants have been carefully measured by X-ray double crystal diffraction. Mismatches between the substrates and epitaxial layers are observed in the direction corresponding to lattice contraction. The variation of fully-relaxed lattice constants calculated from symmetric (004) and asymmetric (115) diffraction shows that the contraction is related to both increasing inlet dopant flows and increasing growth temperatures. Secondary ion mass spectrometry is employed to analyze the elements in the epitaxial layers. The variations of Al, Ga, In and Zn components indicate that a decrease of In incorporation during the growth leads to the contracted lattice, although Zn atoms, which incorporate into the sites of In atoms during the doping, are smaller in covalent radius. The decrease is supposed to be caused by the competition between In and Zn atoms on the growth surface, which is well fit by the surface adsorption-trapping model. In addition, the suppression of Al and Ga incorporation by inlet dopant flows is observed. The possible cause might be the ethane generated by the pyrolysis of dopant source, which impedes the decomposition process of metalorganic sources of Al and Ga atoms. - Highlights: • AlGaInP layers are grown by metalorganic vapor phase epitaxy. • Zn induced lattice contraction in AlGaInP layers is observed. • Diethylzinc flow causes the contraction by impeding the incorporation of In. • The suppression of metalorganic decomposition by diethylzinc is noticed.

  5. Metal-organic aerogel as a coating for solid-phase microextraction

    Energy Technology Data Exchange (ETDEWEB)

    Saraji, Mohammad, E-mail: saraji@cc.iut.ac.ir; Shahvar, Ali

    2017-06-22

    An iron-based metal-organic aerogel was synthesized using metal-organic framework nanoparticles and applied as a fiber coating for solid-phase microextraction (SPME). Chemical, thermal and morphological characteristics of the material were investigated. Headspace SPME followed by gas chromatography-electron capture detection was used for the determination of chlorobenzenes in the environmental samples. The key experimental factors affecting the extraction efficiency of the analytes, such as ionic strength, extraction and desorption temperature, and extraction time were investigated and optimized. The applicability of the coating for the extraction of chlorobenzenes from the environmental samples including river and tap water, sludge, and coastal soil was evaluated. The detection limits were in the range of 0.1–60 ng L{sup −1}. The relative standard deviations were between 2.0 and 5.0%. The extraction recovery of the analytes was in the range of 88–100%. Compared to the commercial PDMS fiber, the present fiber showed better extraction efficiency. - Highlights: • Metal-organic aerogel was synthesized and used as a novel fiber coating for SPME. • The new coating material showed high surface area and good thermal stability. • GC-ECD was used for determination of chlorobenzenes in environmental samples. • The method showed fast extraction and better efficiency than PDMS commercial fiber.

  6. Statistical nature of cluster emission in nuclear liquid-vapour phase coexistence

    International Nuclear Information System (INIS)

    Ma, Y G; Han, D D; Shen, W Q; Cai, X Z; Chen, J G; He, Z J; Long, J L; Ma, G L; Wang, K; Wei, Y B; Yu, L P; Zhang, H Y; Zhong, C; Zhou, X F; Zhu, Z Y

    2004-01-01

    The emission of nuclear clusters is investigated within the framework of the isospin-dependent lattice gas model and the classical molecular dynamics model. It is found that the emission of an individual cluster which is heavier than proton is almost Poissonian except near the transition temperature at which the system is leaving the liquid-vapour phase coexistence and thermal scaling is observed by the linear Arrhenius plots which are made from the average multiplicity of each cluster versus the inverse of temperature in the liquid-vapour phase coexistence. The slopes of the Arrhenius plots, i.e. the 'emission barriers', are extracted as a function of the mass or charge number and fitted by the formula embodied with the contributions of the surface energy and Coulomb interaction. Good agreements are obtained in comparison with the data for low-energy conditional barriers. In addition, the possible influences of the source size, Coulomb interaction and 'freeze-out' density and related physical implications are discussed

  7. Free standing PEDOT films prepared by vapour phase polymerisation as electrically tuneable barriers to drug permeability.

    Science.gov (United States)

    Bansal, Mahima; Sharma, Manisha; Bullen, Chris; Svirskis, Darren

    2018-03-01

    We report the fabrication of PEDOT films using vapour phase polymerisation with Fe(III)tosylate as the oxidant and to provide the doping ion. Multiple polymerisation steps resulted in the formation of free-standing PEDOT films. The PEDOT films were highly conductive, a single layer was 1840±50S/cm with a small decrease in conductivity for the five layered films to 1550±60S/cm. The five-layered films were flexible and freestanding in air with a thickness of 1.66±0.06μm. The ability of the freestanding PEDOT films to act as electrically tuneable rate controlling membranes was determined for nicotine (MW 162.2Da), dexamethasone phosphate (MW 516.4Da) and bovine lactoferrin (MW 80kDa), using a customised Franz cell. The membranes were highly permeable to nicotine and dexamethasone phosphate, however, the large lactoferrin molecules could not diffuse through the PEDOT membranes. The permeability of dexamethasone phosphate could be controlled electrically with an increase in flux observed when the membranes were maintained in the oxidised state compared to the reduce state. This is the first report where free standing PEDOT films were prepared by vapour phase polymerisation; these films were capable of electrically modifiable permeation of small drug molecules. The free standing and highly conductive PEDOT membranes are exciting materials to explore for molecular separation and drug delivery applications. Copyright © 2017 Elsevier B.V. All rights reserved.

  8. Vapour phase corrosion inhibitors from South African renewable resources and their evaluation

    CSIR Research Space (South Africa)

    Vuorinen, E

    2006-02-01

    Full Text Available of the metal. Furfural and furfural derivatives were reacted with different amines to produce potential VCIs. The products were evaluated using a humidity chamber method. A suitable vapour pressure is a requirement for a VCI. Conventional vapour...

  9. Vapour-phase method in the synthesis of polymer-ibuprofen sodium-silica gel composites

    Directory of Open Access Journals (Sweden)

    Agnieszka Kierys

    2017-11-01

    Full Text Available The study discusses the synthesis of polymer-silica composites comprising water soluble drug (ibuprofen sodium, IBS. The polymers selected for this study were poly(TRIM and poly(HEMA-co-TRIM produced in the form of permanently porous beads via the suspension-emulsion polymerization method. The acid and base set ternary composites were prepared by the saturation of the solid dispersions of drug (poly(TRIM-IBS and/or poly(HEMA-co-TRIM-IBS with TEOS, and followed by their exposition to the vapour mixture of water and ammonia, or water and hydrochloric acid, at autogenous pressure. The conducted analyses reveal that the internal structure and total porosity of the resulting composites strongly depend on the catalyst which was used for silica precursor gelation. The parameters characterizing the porosity of both of the acid set composites are much lower than the parameters of the base set composites. Moreover, the basic catalyst supplied in the vapour phase does not affect the ibuprofen sodium molecules, whereas the acid one causes transformation of the ibuprofen sodium into the sodium chloride and a derivative of propanoic acid, which is poorly water soluble. The release profiles of ibuprofen sodium from composites demonstrate that there are differences in the rate and efficiency of drug desorption from them. They are mainly affected by the chemical character of the polymeric carrier but are also associated with the restricted swelling of the composites in the buffer solution after precipitation of silica gel.

  10. Magnetic phase transition induced by electrostatic gating in two-dimensional square metal-organic frameworks

    Science.gov (United States)

    Wang, Yun-Peng; Li, Xiang-Guo; Liu, Shuang-Long; Fry, James N.; Cheng, Hai-Ping

    2018-03-01

    We investigate theoretically magnetism and magnetic phase transitions induced by electrostatic gating of two-dimensional square metal-organic framework compounds. We find that electrostatic gating can induce phase transitions between homogeneous ferromagnetic and various spin-textured antiferromagnetic states. Electronic structure and Wannier function analysis can reveal hybridizations between transition-metal d orbitals and conjugated π orbitals in the organic framework. Mn-containing compounds exhibit a strong d -π hybridization that leads to partially occupied spin-minority bands, in contrast to compounds containing transition-metal ions other than Mn, for which electronic structure around the Fermi energy is only slightly spin split due to weak d -π hybridization and the magnetic interaction is of the Ruderman-Kittel-Kasuya-Yosida type. We use a ferromagnetic Kondo lattice model to understand the phase transition in Mn-containing compounds in terms of carrier density and illuminate the complexity and the potential to control two-dimensional magnetization.

  11. Metal-Organic Framework Thin Films as Stationary Phases in Microfabricated Gas-Chromatography Columns.

    Energy Technology Data Exchange (ETDEWEB)

    Read, Douglas [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); Sillerud, Colin Halliday [Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)

    2016-01-01

    The overarching goal of this project is to integrate Sandia's microfabricated gas-chromatography ( GC) columns with a stationary phase material that is capable of retaining high-volatility chemicals and permanent gases. The successful integration of such a material with GCs would dramatically expand the repertoire of detectable compounds for Sandia's various microanalysis systems. One such promising class of candidate materials is metal-organic frameworks (MOFs). In this report we detail our methods for controlled deposition of HKUST-1 MOF stationary phases within GC columns. We demonstrate: the chromatographic separation of natural gas; a method for determining MOF film thickness from chromatography alone; and the first-reported GC x GC separation of natural gas -- in general -- let alone for two disparate MOF stationary phases. In addition we determine the fundamental thermodynamic constant for mass sorption, the partition coefficient, for HKUST-1 and several light hydrocarbons and select toxic industrial chemicals.

  12. Thermodynamically equilibrium roton states of nanoparticles in molten and vapour phases

    Science.gov (United States)

    Karasevskii, A. I.

    2015-05-01

    We show a possibility for a thermodynamically equilibrium nanocrystalline structure consisting of nanosized solid inclusions to appear in a melt just beyond the melting curve. Thermodynamic stability of the nanocrystalline structure in the melt results from the free energy lowering due to rotational motion of nanoparticles. The main contribution to the reduction of the free energy of the system is due to an increase in the rotational entropy and change in formation energy of nanocrystals, i.e. the nanocrystalline structure in the melt, like vacancies in a crystal, is an equilibrium defect structure of the melt. It is demonstrated that similar nanocrystalline structures can also appear in the vapour phase in the form of liquid nanodrops and in liquid solutions, e.g. in He II.

  13. Quantification of Selected Vapour-Phase Compounds using Thermal Desorption-Gas Chromatography

    Directory of Open Access Journals (Sweden)

    McLaughlin DWJ

    2014-12-01

    Full Text Available A robust method for the analysis of selected vapour phase (VP compounds in mainstream smoke (MSS is described. Cigarettes are smoked on a rotary smoking machine and the VP that passes through the Cambridge filter pad collected in a TedlarA¯ bag. On completion of smoking, the bag contents are sampled onto an adsorption tube containing a mixed carbon bed. The tube is subsequently analysed on an automated thermal desorption (TD system coupled to a gas chromatography-flame ionization detector (GC-FID using a PoraPLOT-Q column. Quantification of 14 volatile compounds including the major carbonyls is achieved. Details of the method validation data are included in this paper. This method has been used to analyse the VP of cigarette MSS over a wide range of ‘tar’ deliveries and configurations with excellent repeatability. Results for the University of Kentucky reference cigarette 1R4F are in good agreement with reported values.

  14. Experimental comparison of chiral metal-organic framework used as stationary phase in chromatography.

    Science.gov (United States)

    Xie, Sheng-Ming; Zhang, Mei; Fei, Zhi-Xin; Yuan, Li-Ming

    2014-10-10

    Chiral metal-organic frameworks (MOFs) are a new class of multifunctional material, which possess diverse structures and unusual properties such as high surface area, uniform and permanent cavities, as well as good chemical and thermal stability. Their chiral functionality makes them attractive as novel enantioselective adsorbents and stationary phases in separation science. In this paper, the experimental comparison of a chiral MOF [In₃O(obb)₃(HCO₂)(H₂O)] solvent used as a stationary phase was investigated in gas chromatography (GC), high-performance liquid chromatography (HPLC) and capillary electrochromatography (CEC). The potential relationship between the structure and components of chiral MOFs with their chiral recognition ability and selectivity are presented. Copyright © 2014 Elsevier B.V. All rights reserved.

  15. Investigating the heat transfer on the top side of inclined printed circuit boards during vapour phase soldering

    International Nuclear Information System (INIS)

    Illés, Balázs; Géczy, Attila

    2016-01-01

    Highlights: • Investigating the effect of inclination on heat transfer uniformity and intensity during VPS. • Even moderate inclination has high impact on the condensate layer and on the heat transfer. • Inclination under 1° has negative effect on temperature distribution of the soldered board. • Inclination from 1° to 10° improves heat transfer uniformity of vapour phase soldering. • Inclination can help to reduce soldering failures during vapour phase soldering. - Abstract: In this paper, heat transfer and condensate layer formation was investigated by numerical simulations on the top side of inclined printed circuit boards during vapour phase soldering. The phase change on the inclined surface and the transfer mechanisms in the condensate layer were embedded in a three-dimensional model. Steady-state and saturated vapour conditions were applied as boundary conditions in order to study the pure effect of the inclination. Due to the electronic component and circuit board structures during soldering only moderate inclination angles were studied between 0° and 10°. It was found that a moderate inclination of the printed circuit board has considerable effects on the formation of condensate layer and consequently on heat transfer. Compared to the default horizontal orientation of the board, the thickness differences of the condensate layer can be decreased with an optimised inclination of the printed circuit board. This effect homogenizes heat transfer during the process, enabling improved solder joint quality, with reduced overall soldering failure count.

  16. Probing the Gas-Phase Dynamics of Graphene Chemical Vapour Deposition using in-situ UV Absorption Spectroscopy

    DEFF Research Database (Denmark)

    Shivayogimath, Abhay; Mackenzie, David; Luo, Birong

    2017-01-01

    The processes governing multilayer nucleation in the chemical vapour deposition (CVD) of graphene are important for obtaining high-quality monolayer sheets, but remain poorly understood. Here we show that higher-order carbon species in the gas-phase play a major role in multilayer nucleation...... the overall mechanism of graphene growth....

  17. High-quality single crystalline NiO with twin phases grown on sapphire substrate by metalorganic vapor phase epitaxy

    Directory of Open Access Journals (Sweden)

    Kazuo Uchida

    2012-12-01

    Full Text Available High-quality single crystalline twin phase NiO grown on sapphire substrates by metalorganic vapor phase epitaxy is reported. X-ray rocking curve analysis of NiO films grown at different temperatures indicates a minimum full width at half maximum of the cubic (111 diffraction peak of 0.107° for NiO film grown at as low as 550 °C. Detailed microstructural analysis by Φ scan X-ray diffraction and transmission electron microscopy reveal that the NiO film consists of large single crystalline domains with two different crystallographic orientations which are rotated relative to each other along the [111] axis by 60°. These single crystal domains are divided by the twin phase boundaries.

  18. Development of InN metalorganic vapor phase epitaxy using in-situ spectroscopic ellipsometry

    Energy Technology Data Exchange (ETDEWEB)

    Drago, M.; Werner, C.; Pristovsek, M.; Pohl, U.W. [Technische Universitaet Berlin, Institut fuer Festkoerperphysik, Hardenbergstrasse 36, 10623 Berlin (Germany); Richter, W. [Universita di Roma ' ' Torvergata' ' , Dipartimento di Fisica, Via della ricerca scientifica 1, I-00133 Roma (Italy)

    2005-11-01

    Metalorganic vapor phase epitaxy of InN layers on sapphire was studied in-situ by spectroscopic ellipsometry (SE), ex-situ atomic force microscopy and optical microscopy. Surface morphology has been largely improved by using nitrogen instead of hydrogen as carrier gas during sapphire nitridation. Using the sensitivity of in-situ SE with respect to roughness we established a new growth procedure with low V/III ratio (10{sup 4}) at high temperature (580 C) and growth rates as high as 350 nm/h, leading to improved electronic layer properties and allowing for growth of comparably thick layers. (copyright 2005 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  19. Aluminum Gallium Nitride Alloys Grown via Metalorganic Vapor-Phase Epitaxy Using a Digital Growth Technique

    Science.gov (United States)

    Rodak, L. E.; Korakakis, D.

    2011-04-01

    This work investigates the use of a digital growth technique as a viable method for achieving high-quality aluminum gallium nitride (Al x Ga1- x N) films via metalorganic vapor-phase epitaxy. Digital alloys are superlattice structures with period thicknesses of a few monolayers. Alloys with an AlN mole fraction ranging from 0.1 to 0.9 were grown by adjusting the thickness of the AlN layer in the superlattice. High-resolution x-ray diffraction was used to determine the superlattice period and c-lattice parameter of the structure, while reciprocal-space mapping was used to determine the a-lattice parameter and evaluate growth coherency. A comparison of the measured lattice parameter with both the nominal value and also the underlying buffer layer is discussed.

  20. Liquid- and Gas-Phase Diffusion of Ferrocene in Thin Films of Metal-Organic Frameworks

    Directory of Open Access Journals (Sweden)

    Wencai Zhou

    2015-06-01

    Full Text Available The mass transfer of the guest molecules in nanoporous host materials, in particular in metal-organic frameworks (MOFs, is among the crucial features of their applications. By using thin surface-mounted MOF films in combination with a quartz crystal microbalance (QCM, the diffusion of ferrocene vapor and of ethanolic and hexanic ferrocene solution in HKUST-1 was investigated. For the first time, liquid- and gas-phase diffusion in MOFs was compared directly in the identical sample. The diffusion coefficients are in the same order of magnitude (~10−16 m2·s−1, whereas the diffusion coefficient of ferrocene in the empty framework is roughly 3-times smaller than in the MOF which is filled with ethanol or n-hexane.

  1. In situ X-ray investigation of changing barrier growth temperatures on InGaN single quantum wells in metal-organic vapor phase epitaxy

    International Nuclear Information System (INIS)

    Ju, Guangxu; Honda, Yoshio; Tabuchi, Masao; Takeda, Yoshikazu; Amano, Hiroshi

    2014-01-01

    The effects of GaN quantum barriers with changing growth temperatures on the interfacial characteristics of GaN/InGaN single quantum well (SQW) grown on GaN templates by metalorganic vapour phase epitaxy were in situ investigated by X-ray crystal truncation rod (CTR) scattering and X-ray reflectivity measurements at growth temperature using a laboratory level X-ray diffractometer. Comparing the curve-fitting results of X-ray CTR scattering spectra obtained at growth temperature with that at room temperature, the In x Ga 1-x N with indium composition less than 0.11 was stabile of the indium distribution at the interface during the whole growth processes. By using several monolayers thickness GaN capping layer to protect the InGaN well layer within temperature-ramping process, the interfacial structure of the GaN/InGaN SQW was drastically improved on the basis of the curve-fitting results of X-ray CTR scattering spectra, and the narrow full width at half-maximum and strong luminous intensity were observed in room temperature photoluminescence spectra

  2. Vapour Phase Hydrogenation of Phenol over Rhodium on SBA-15 and SBA-16

    Directory of Open Access Journals (Sweden)

    Liliana Giraldo

    2014-12-01

    Full Text Available In the present work, mesoporous SBA-15 and SBA-16 were synthesised using classical methods, and their physicochemical properties were investigated by X-ray diffraction (XRD, FTIR, TEM and N2 adsorption–desorption. Rhodium (Rh, 1 wt % was loaded on the mesoporous SBA-15 and SBA-16 by an impregnation method. The Rh surface coverage, dispersion and crystallite size were determined by room temperature H2 chemisorption on reduced samples. The catalytic activity of Rh supported on mesoporous SBA-15 and SBA-16 was evaluated for the first time in the hydrogenation of phenol in vapour phase in a temperature range between 130 and 270 °C at atmospheric pressure. The reaction over Rh/SBA-15 at 180 °C produced cyclohexanone as the major product (about 60% along with lower amounts of cyclohexanol (about 35% and cyclohexane (about 15%. The influences of temperature, H2/phenol ratio, contact time and the nature of the solvent on the catalytic performance were systematically investigated. The Rh/SBA-16 system offered lower phenol conversion compared to Rh/SBA-15, but both have a very high selectivity for cyclohexanone (above 60%.

  3. Vapour phase dehydration of glycerol to acrolein over tungstated zirconia catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Rao Ginjupalli, Srinivasa; Mugawar, Sowmya; Rajan, Pethan N.; Kumar Balla, Putra; Chary Komandur, V.R., E-mail: kvrchary@iict.res.in

    2014-08-01

    Tetragonal (TZ) and monoclinic (MZ) polymorphs of zirconia supports were synthesised by sol–gel method followed by variation of the calcination temperature. Tungstated (10 wt% WO{sub 3}) supported on the zirconia polymorphs were prepared by impregnation method by using ammonium metatungstate precursor. The physico-chemical properties of the calcined catalysts were characterised by X-ray diffraction, UV–vis diffused reflectance spectroscopy, X-ray photoelectron spectroscopy (XPS), surface area and pore size distribution measurements to gain insight into the effect of morphology of the catalyst textural properties, and structure. The surface acidic properties have been determined by NH{sub 3} TPD method and also with FT-IR spectra of pyridine adsorption. Vapour phase dehydration of glycerol to acrolein was employed to investigate the catalytic functionalities. Glycerol conversion and acrolein selectivity was mainly dependent on the fraction of moderate acid sites with majority of them are due to Brønsted acidic sites. Monoclinic zirconia based catalysts have shown the highest activity and acrolein selectivity compared to the corresponding tetragonal zirconia catalysts.

  4. The characterisation of vapour-phase alkali metal-tellurium-oxygen species

    International Nuclear Information System (INIS)

    Gomme, R.A.; Ogden, J.S.; Bowsher, B.R.

    1986-10-01

    Detailed assessments of hypothetical severe accidents in light water reactors require the identification of the chemical forms of the radionuclides in order to determine their transport characteristics. Caesium and tellurium are important volatile fission products in accident scenarios. This report describes detailed studies to characterise the chemical species that vaporise from heated mixtures of various alkali metal-tellurium-oxygen systems. The molecular species were characterised by a combination of quadrupole mass spectrometry and matrix isolation-infrared spectroscopy undertaken in conjunction with experiments involving oxygen-18 substitution. The resulting spectra were interpreted in terms of a vapour-phase molecule with the stoichiometry M 2 TeO 3 (M = K,Rb,Cs) for M/Te molecular ratios of ∼ 2, and polymeric species for ratios < 2. This work has demonstrated the stability of caesium tellurite. The formation of this relatively low-volatility, water-soluble species could significantly modify the transport and release of caesium and tellurium. The data presented in this report should allow more comprehensive thermodynamic calculations to be undertaken that assist in the quantification of fission product behaviour during severe reactor accidents. (author)

  5. Vapour phase dehydration of glycerol to acrolein over tungstated zirconia catalysts

    Science.gov (United States)

    Rao Ginjupalli, Srinivasa; Mugawar, Sowmya; Rajan N., Pethan; Kumar Balla, Putra; Chary Komandur, V. R.

    2014-08-01

    Tetragonal (TZ) and monoclinic (MZ) polymorphs of zirconia supports were synthesised by sol-gel method followed by variation of the calcination temperature. Tungstated (10 wt% WO3) supported on the zirconia polymorphs were prepared by impregnation method by using ammonium metatungstate precursor. The physico-chemical properties of the calcined catalysts were characterised by X-ray diffraction, UV-vis diffused reflectance spectroscopy, X-ray photoelectron spectroscopy (XPS), surface area and pore size distribution measurements to gain insight into the effect of morphology of the catalyst textural properties, and structure. The surface acidic properties have been determined by NH3 TPD method and also with FT-IR spectra of pyridine adsorption. Vapour phase dehydration of glycerol to acrolein was employed to investigate the catalytic functionalities. Glycerol conversion and acrolein selectivity was mainly dependent on the fraction of moderate acid sites with majority of them are due to Brønsted acidic sites. Monoclinic zirconia based catalysts have shown the highest activity and acrolein selectivity compared to the corresponding tetragonal zirconia catalysts.

  6. Vapour phase dehydration of glycerol to acrolein over tungstated zirconia catalysts

    International Nuclear Information System (INIS)

    Rao Ginjupalli, Srinivasa; Mugawar, Sowmya; Rajan, Pethan N.; Kumar Balla, Putra; Chary Komandur, V.R.

    2014-01-01

    Tetragonal (TZ) and monoclinic (MZ) polymorphs of zirconia supports were synthesised by sol–gel method followed by variation of the calcination temperature. Tungstated (10 wt% WO 3 ) supported on the zirconia polymorphs were prepared by impregnation method by using ammonium metatungstate precursor. The physico-chemical properties of the calcined catalysts were characterised by X-ray diffraction, UV–vis diffused reflectance spectroscopy, X-ray photoelectron spectroscopy (XPS), surface area and pore size distribution measurements to gain insight into the effect of morphology of the catalyst textural properties, and structure. The surface acidic properties have been determined by NH 3 TPD method and also with FT-IR spectra of pyridine adsorption. Vapour phase dehydration of glycerol to acrolein was employed to investigate the catalytic functionalities. Glycerol conversion and acrolein selectivity was mainly dependent on the fraction of moderate acid sites with majority of them are due to Brønsted acidic sites. Monoclinic zirconia based catalysts have shown the highest activity and acrolein selectivity compared to the corresponding tetragonal zirconia catalysts.

  7. The Liquid Vapour Interface

    DEFF Research Database (Denmark)

    Als-Nielsen, Jens Aage

    1985-01-01

    In this short review we are concerned with the density variation across the liquid-vapour interface, i.e. from the bulk density of the liquid to the essentially zero density of the vapour phase. This density variation can in principle be determined from the deviation of the reflectivity from...

  8. Catalytic Functionalities of Nano Ruthenium/gamma-Al2O3 Catalysts for the Vapour Phase Hydrogenolysis of Glycerol.

    Science.gov (United States)

    Kumar, Vanama Pavan; Priya, Samudrala Shanthi; Harikrishna, Yengaidas; Kumar, Ashish; Chary, Komandur V R

    2016-02-01

    A series of Ruthenium catalysts with different Ru contents supported on gamma-alumina were prepared by deposition-precipitation method. The catalysts were characterized by X-ray diffraction (XRD), trans- mission electron microscopy (TEM), temperature programmed reduction (TPR), CO-chemisorption, surface area and pore-size distribution (PSD) measurements. The catalytic activities were evaluated for the vapour phase hydrogenolysis of glycerol to propanediols. The pore size distribution (PSD) results suggest that Ru loadings considerably affect the pore volume, pore diameter and surface area. The particle size measured from CO-chemisorption and TEM analysis are well correlated to the activity results during the hydrogenolysis reaction. The catalytic properties of Ru/gamma-Al2O3 catalysts were evaluated for the first time over vapour phase hydrogenolysis of glycerol to propanediols.

  9. In situ topography of the (2 0 0) face of ɛ-caprolactam growing from the vapour phase

    Science.gov (United States)

    van den Berg, E. P. G.; Sweegers, A. J. R.; Verheijen, M. A.; van Enckevort, W. J. P.

    1997-09-01

    On the (2 0 0) face of ɛ-caprolactam growing from the vapour phase several growth phenomena were observed in situ by optical microscopy: single spirals, multiple spirals, spirals growing with monomolecular steps, Vapor-liquid-solid (VLS) growth and two-dimensional nucleation. From the observations and measured growth rates the relative importance of the volume, surface diffusion and step integration as the rate determining step of the growth process are elaborated.

  10. Phase degradation in BxGa1-xN films grown at low temperature by metalorganic vapor phase epitaxy

    Science.gov (United States)

    Gunning, Brendan P.; Moseley, Michael W.; Koleske, Daniel D.; Allerman, Andrew A.; Lee, Stephen R.

    2017-04-01

    Using metalorganic vapor phase epitaxy, a comprehensive study of BxGa1-xN growth on GaN and AlN templates is described. BGaN growth at high-temperature and high-pressure results in rough surfaces and poor boron incorporation efficiency, while growth at low-temperature and low-pressure (750-900 °C and 20 Torr) using nitrogen carrier gas results in improved surface morphology and boron incorporation up to 7.4% as determined by nuclear reaction analysis. However, further structural analysis by transmission electron microscopy and x-ray pole figures points to severe degradation of the high boron composition films, into a twinned cubic structure with a high density of stacking faults and little or no room temperature photoluminescence emission. Films with peaks, near-band-edge photoluminescence emission at 362 nm, and primarily wurtzite-phase structure in the x-ray pole figures. For films with >1% TEB flow, the crystal structure becomes dominated by the cubic phase. Only when the TEB flow is zero (pure GaN), does the cubic phase entirely disappear from the x-ray pole figure, suggesting that under these growth conditions even very low boron compositions lead to mixed crystalline phases.

  11. Development of a simple and low cost device for vapour phase Fourier Transform Infrared spectrometry determination of ethanol in mouthwashes

    Energy Technology Data Exchange (ETDEWEB)

    Armenta, Sergio [Department of Analytical Chemistry, Universitat de Valencia, Edifici Jeroni Munoz, 50th Dr. Moliner, 46100 BURJASSOT, Valencia (Spain); Esteve-Turrillas, Francesc A. [Department of Analytical Chemistry, Universitat de Valencia, Edifici Jeroni Munoz, 50th Dr. Moliner, 46100 BURJASSOT, Valencia (Spain); Quintas, Guillermo [Department of Analytical Chemistry, Universitat de Valencia, Edifici Jeroni Munoz, 50th Dr. Moliner, 46100 BURJASSOT, Valencia (Spain); Garrigues, Salvador [Department of Analytical Chemistry, Universitat de Valencia, Edifici Jeroni Munoz, 50th Dr. Moliner, 46100 BURJASSOT, Valencia (Spain)]. E-mail: Salvador.garrigues@uv.es; Pastor, Agustin [Department of Analytical Chemistry, Universitat de Valencia, Edifici Jeroni Munoz, 50th Dr. Moliner, 46100 BURJASSOT, Valencia (Spain); Guardia, Miguel de la [Department of Analytical Chemistry, Universitat de Valencia, Edifici Jeroni Munoz, 50th Dr. Moliner, 46100 BURJASSOT, Valencia (Spain)

    2006-05-31

    A new vapour phase manifold coupled with Fourier Transform Infrared (FTIR) spectroscopy was developed for ethanol determination in mouthwashes. Two microliters of samples were injected, without any previous pre-treatment into a reactor heated at 70 deg. C, and the vapour phase generated transported to the FTIR spectrometer using a carrier nitrogen flow of 6 ml min{sup -1}. FTIR spectra were continuously recorded, as a function of time, by accumulating two scans and employing 8 cm{sup -1} nominal resolution. Analytical measurements for ethanol were made in the range from 1130 to 992 cm{sup -1} with a baseline defined between 1158 and 957 cm{sup -1}. After ethanol measurement the carrier flow was increased to 300 ml min{sup -1} in order to put out of the manifold the water evolved from samples. Several commercial mouthwash samples were analysed by reference methods as titrimetry and headspace gas chromatography and results were comparable with those obtained by vapour phase FTIR. The proposed procedure is a simple, fast and environmentally friendly alternative to the reference methods providing accurate results, with a limit of detection of 0.15% (v/v) and a total analysis time of 2 min.

  12. Liquid-phase extraction coupled with metal-organic frameworks-based dispersive solid phase extraction of herbicides in peanuts.

    Science.gov (United States)

    Li, Na; Wang, Zhibing; Zhang, Liyuan; Nian, Li; Lei, Lei; Yang, Xiao; Zhang, Hanqi; Yu, Aimin

    2014-10-01

    Liquid-phase extraction coupled with metal-organic frameworks-based dispersive solid phase extraction was developed and applied to the extraction of pesticides in high fatty matrices. The herbicides were ultrasonically extracted from peanut using ethyl acetate as extraction solvent. The separation of the analytes from a large amount of co-extractive fat was achieved by dispersive solid-phase extraction using MIL-101(Cr) as sorbent. In this step, the analytes were adsorbed on MIL-101(Cr) and the fat remained in bulk. The herbicides were separated and determined by high-performance liquid chromatography. The experimental parameters, including type and volume of extraction solvent, ultrasonication time, volume of hexane and eluting solvent, amount of MIL-101(Cr) and dispersive solid phase extraction time, were optimized. The limits of detection for herbicides range from 0.98 to 1.9 μg/kg. The recoveries of the herbicides are in the range of 89.5-102.7% and relative standard deviations are equal or lower than 7.0%. The proposed method is simple, effective and suitable for treatment of the samples containing high content of fat. Copyright © 2014 Elsevier B.V. All rights reserved.

  13. Experimental and numerical study of two-phase flows at the inlet of evaporators in vapour compression cycles

    International Nuclear Information System (INIS)

    Ahmad, M.

    2007-09-01

    Maldistribution of liquid-vapour two phase flows causes a significant decrease of the thermal and hydraulic performance of evaporators in thermodynamic vapour compression cycles. A first experimental installation was used to visualize the two phase flow evolution between the expansion valve and the evaporator inlet. A second experimental set-up simulating a compact heat exchanger has been designed to identify the functional and geometrical parameters creating the best distribution of the two phases in the different channels. An analysis and a comprehension of the relation between the geometrical and functional parameters with the flow pattern inside the header and the two phase distribution, has been established. A numerical simulations of a stratified flow and a stratified jet flow have been carried out using two CFD codes: FLUENT and NEPTUNE. In the case of a fragmented jet configuration, a global definition of the interfacial area concentration for a separated phases and dispersed phases flow has been established and a model calculating the fragmented mass fraction has been developed. (author)

  14. Development of graphene nanoplatelet embedded polymer microcantilever for vapour phase explosive detection applications

    International Nuclear Information System (INIS)

    Ray, Prasenjit; Pandey, Swapnil; Ramgopal Rao, V.

    2014-01-01

    In this work, a graphene based strain sensor has been reported for explosive vapour detection applications by exploiting the piezoresistive property of graphene. Instead of silicon based cantilevers, a low cost polymeric micro-cantilever platform has been used to fabricate this strain sensor by embedding the graphene nanoplatelet layer inside the beam. The fabricated devices were characterized for their mechanical and electromechanical behaviour. This device shows a very high gauge factor which is around ∼144. Also the resonant frequency of these cantilevers is high enough such that the measurements are not affected by environmental noise. These devices have been used in this work for reliable detection of explosive vapours such as 2,4,6-Trinitrotoluene down to parts-per-billion concentrations in ambient conditions.

  15. Convective heat transfer measurements in a vapour-liquid-liquid three-phase direct contact heat exchanger

    Science.gov (United States)

    Mahood, Hameed B.; Campbell, A. N.; Baqir, Ali Sh.; Sharif, A. O.; Thorpe, R. B.

    2017-12-01

    Energy usage is increasing around the world due to the continued development of technology, and population growth. Solar energy is a promising low-grade energy resource that can be harvested and utilised in different applications, such solar heater systems, which are used in both domestic and industrial settings. However, the implementation of an efficient energy conversion system or heat exchanger would enhance such low-grade energy processes. The direct contact heat exchanger could be the right choice due to its ability to efficiently transfer significant amounts of heat, simple design, and low cost. In this work, the heat transfer associated with the direct contact condensation of pentane vapour bubbles in a three-phase direct contact condenser is investigated experimentally. Such a condenser could be used in a cycle with a solar water heater and heat recovery systems. The experiments on the steady state operation of the three-phase direct contact condenser were carried out using a short Perspex tube of 70 cm in total height and an internal diameter of 4 cm. Only a height of 48 cm was active as the direct contact condenser. Pentane vapour, (the dispersed phase) with three different initial temperatures (40° C, 43.5° C and 47.5° C) was directly contacted with water (the continuous phase) at 19° C. The experimental results showed that the total heat transfer rate per unit volume along the direct contact condenser gradually decreased upon moving higher up the condenser. Additionally, the heat transfer rate increases with increasing mass flow rate ratio, but no significant effect on the heat transfer rate of varying the initial temperature of the dispersed phase was seen. Furthermore, both the outlet temperature of the continuous phase and the void fraction were positively correlated with the total heat transfer rate per unit volume, with no considerable effect of the initial temperature difference between the dispersed and continuous phases.

  16. Probing the Gas-Phase Dynamics of Graphene Chemical Vapour Deposition using in-situ UV Absorption Spectroscopy.

    Science.gov (United States)

    Shivayogimath, Abhay; Mackenzie, David; Luo, Birong; Hansen, Ole; Bøggild, Peter; Booth, Timothy J

    2017-07-21

    The processes governing multilayer nucleation in the chemical vapour deposition (CVD) of graphene are important for obtaining high-quality monolayer sheets, but remain poorly understood. Here we show that higher-order carbon species in the gas-phase play a major role in multilayer nucleation, through the use of in-situ ultraviolet (UV) absorption spectroscopy. These species are the volatilized products of reactions between hydrogen and carbon contaminants that have backstreamed into the reaction chamber from downstream system components. Consequently, we observe a dramatic suppression of multilayer nucleation when backstreaming is suppressed. These results point to an important and previously undescribed mechanism for multilayer nucleation, wherein higher-order gas-phase carbon species play an integral role. Our work highlights the importance of gas-phase dynamics in understanding the overall mechanism of graphene growth.

  17. Sub-10-nm patterning via directed self-assembly of block copolymer films with a vapour-phase deposited topcoat

    Science.gov (United States)

    Suh, Hyo Seon; Kim, Do Han; Moni, Priya; Xiong, Shisheng; Ocola, Leonidas E.; Zaluzec, Nestor J.; Gleason, Karen K.; Nealey, Paul F.

    2017-07-01

    Directed self-assembly (DSA) of the domain structure in block copolymer (BCP) thin films is a promising approach for sub-10-nm surface patterning. DSA requires the control of interfacial properties on both interfaces of a BCP film to induce the formation of domains that traverse the entire film with a perpendicular orientation. Here we show a methodology to control the interfacial properties of BCP films that uses a polymer topcoat deposited by initiated chemical vapour deposition (iCVD). The iCVD topcoat forms a crosslinked network that grafts to and immobilizes BCP chains to create an interface that is equally attractive to both blocks of the underlying copolymer. The topcoat, in conjunction with a chemically patterned substrate, directs the assembly of the grating structures in BCP films with a half-pitch dimension of 9.3 nm. As the iCVD topcoat can be as thin as 7 nm, it is amenable to pattern transfer without removal. The ease of vapour-phase deposition, applicability to high-resolution BCP systems and integration with pattern-transfer schemes are attractive properties of iCVD topcoats for industrial applications.

  18. Vapour-phase crystallisation of silica from SiF4-bearing volcanic gases

    Directory of Open Access Journals (Sweden)

    M. H. G. Jacobs

    2005-06-01

    Full Text Available Thermodynamic modelling of magmatic gases shows that SiF4 may be an important F-bearing species at the high pressures typical of magma reservoirs. Upon decompression during degassing, SiF4 will react with water vapour to form HF and silica. Common magmatic gases of high-T fumaroles seem to contain too little SiF4 to be a significant source of silica, except if extremely large amounts of gas percolate through a small volume of rock, as is the case in lava domes. Only if fluorine contents of the gases exceed 1 mol% detectable amounts of silica may be formed, but such high fluorine contents have not yet been observed in natural gases. Alternatively, silica may be formed by heating of cool SiF4-rich gases circulating in cooling lava bodies. We suggest that these mechanisms may be responsible for the deposition of crystalline silica, most probably cristobalite, observed in vesicles in lavas from Lewotolo volcano (Eastern Sunda Arc, Indonesia. Silica occurs as vapour-crystallised patches in vesicles, and is sometimes associated with F-phlogopite, which further supports F-rich conditions during deposition. Because of the connection between F-rich conditions and high-K volcanism, we propose that late-stage gaseous transport and deposition of silica may be more widespread in K-rich volcanoes than elsewhere, and long-term exposure to ash from eruptions of such volcanoes could therefore carry an increased risk for respiratory diseases. The dependence of SiF4/HF on temperature reported here differs from the current calibration used for temperature measurements of fumarolic gases by remote sensing techniques, and we suggest an updated calibration.

  19. The use of vapour phase ultra-violet spectroscopy for the analysis of arson accelerants in fire scene debris.

    Science.gov (United States)

    McCurdy, R J; Atwell, T; Cole, M D

    2001-12-01

    A method has been developed for the analysis of arson accelerants in fire scene debris by vapour phase ultra-violet (UV) spectroscopy. The method is rapid, inexpensive, simple to use and is sufficiently sensitive and discriminating to be of use for the analysis of crime scene samples. Application to casework samples is described. On occasion, the method offers additional information to that which can be obtained by gas chromatography-flame ionisation detection (GC-FID) and gas chromatography-mass spectrometry (GC-MS) and represents a useful adjunct to these techniques. In addition, the method offers advantages where the use of GC-MS analysis of arson accelerants in fire scene debris is not a practical proposition.

  20. Investigations of vapour-phase deposited transition metal dichalcogenide films for future electronic applications

    Science.gov (United States)

    Gatensby, Riley; Hallam, Toby; Lee, Kangho; McEvoy, Niall; Duesberg, Georg S.

    2016-11-01

    Two-dimensional (2D) transitional metal dichalcogenides (TMDs) are of major interest to the research and electrical engineering community. A number of TMDs are semiconducting and have a wide range of bandgaps, they can exhibit n- or p-type behaviour, and the electronic structure changes with the number of layers. These exceptional properties hold much promise for a host of electrical applications including low- or high power field-effect transistors, sensors and diodes. Moreover, the unique optical properties of TMDs make them attractive for optoelectronic applications such as light-emitting diodes, photodiodes, and photovoltaic cells. A prerequisite for all of these applications is a synthesis route which is well controlled, scalable, reproducible and compatible with semiconductor industry process flows. Thermally assisted conversion (TAC), a variant of chemical vapour deposition, shows much promise for meeting these requirements. Herein we review the current progress and challenges of research on 2D semiconducting materials for electronics with a special focus on TAC produced TMD thin films.

  1. An in situ vapour phase hydrothermal surface doping approach for fabrication of high performance Co3O4 electrocatalysts with an exceptionally high S-doped active surface.

    Science.gov (United States)

    Tan, Zhijin; Liu, Porun; Zhang, Haimin; Wang, Yun; Al-Mamun, Mohammad; Yang, Hua Gui; Wang, Dan; Tang, Zhiyong; Zhao, Huijun

    2015-04-04

    A facile in situ vapour phase hydrothermal (VPH) surface doping approach has been developed for fabrication of high performance S-doped Co3O4 electrocatalysts with an unprecedentedly high surface S content (>47%). The demonstrated VPH doping approach could be useful for enrichment of surface active sites for other metal oxide electrocatalysts.

  2. Liquid and vapour-phase antifungal activities of essential oils against Candida albicans and non-albicans Candida.

    Science.gov (United States)

    Mandras, Narcisa; Nostro, Antonia; Roana, Janira; Scalas, Daniela; Banche, Giuliana; Ghisetti, Valeria; Del Re, Simonetta; Fucale, Giacomo; Cuffini, Anna Maria; Tullio, Vivian

    2016-08-30

    The management of Candida infections faces many problems, such as a limited number of antifungal drugs, toxicity, resistance of Candida to commonly antifungal drugs, relapse of Candida infections, and the high cost of antifungal drugs. Though azole antifungal agents and derivatives continue to dominate as drugs of choice against Candida infections, there are many available data referring to the anticandidal activity of essential oils. Since we have previous observed a good antimicrobial activity of some essential oils against filamentous fungi, the aim of this study was to extend the research to evaluate the activity of the same oils on Candida albicans, C.glabrata and C.tropicalis clinical strains, as well as the effects of related components. Essential oils selection was based both on ethnomedicinal use and on proved antibacterial and/or antifungal activity of some of these oils. Fluconazole and voriconazole were used as reference drugs. The minimum inhibitory concentration (MIC) and the minimal fungicidal concentration (MFC) of essential oils (thyme red, fennel, clove, pine, sage, lemon balm, and lavender) and their major components were investigated by the broth microdilution method (BM) and the vapour contact assay (VC). Using BM, pine oil showed the best activity against all strains tested, though C.albicans was more susceptible than C.glabrata and C.tropicalis (MIC50-MIC90 = 0.06 %, v/v). On the contrary, sage oil displayed a weak activity (MIC50-MIC90 = 1 %, v/v). Thyme red oil (MIC50-MIC90 ≤ 0.0038 %, v/v for C.albicans and C.tropicalis, and 0.0078- Candida spp., including fluconazole/voriconazole resistant strains. These data encourage adequately controlled and randomized clinical investigations. The use in vapour phase could have additional advantages without requiring direct contact, resulting in easy of environmental application such as in hospital, and/or in school.

  3. Dispersive micro-solid-phase extraction of herbicides in vegetable oil with metal-organic framework MIL-101.

    Science.gov (United States)

    Li, Na; Zhang, Liyuan; Nian, Li; Cao, Bocheng; Wang, Zhibing; Lei, Lei; Yang, Xiao; Sui, Jiaqi; Zhang, Hanqi; Yu, Aimin

    2015-03-04

    Dispersive microsolid-phase extraction based on metal-organic framework has been developed and applied to the extraction of triazine and phenylurea herbicides in vegetable oils in this work. The herbicides were directly extracted with MIL-101 from diluted vegetables oils without any further cleanup. The separation and determination of herbicides were carried out on high performance liquid chromatography. The effects of experimental parameters, including volume ratio of n-hexane to oil sample, mass of MIL-101, extraction time, centrifugation time, eluting solvent, and elution time were investigated. The Student's t test was applied to evaluate the selected experimental conditions. The limits of detection for the herbicides ranged from 0.585 to 1.04 μg/L. The recoveries of the herbicides ranged from 87.3 to 107%. Our results showed that the present method is rapid, simple, and effective for extracting herbicides in vegetable oils.

  4. Pulsed injection metal organic chemical vapour deposition and characterisation of thin CaO films

    Energy Technology Data Exchange (ETDEWEB)

    Borges, R.P., E-mail: rpborges@fc.ul.p [Centro de Fisica da Materia Condensada, Universidade de Lisboa, Campo Grande, Ed. C8, 1749-016 Lisboa (Portugal); Ferreira, P. [Departamento de Engenharia Ceramica e do Vidro, CICECO, Universidade de Aveiro, Campus Universitario de Santiago, 3810-193 Aveiro (Portugal); Saraiva, A. [Centro de Fisica da Materia Condensada, Universidade de Lisboa, Campo Grande, Ed. C8, 1749-016 Lisboa (Portugal); Goncalves, R., E-mail: rjbarrosog@hotmail.co [Centro de Fisica da Materia Condensada, Universidade de Lisboa, Campo Grande, Ed. C8, 1749-016 Lisboa (Portugal); Rosa, M.A. [Centro de Fisica da Materia Condensada, Universidade de Lisboa, Campo Grande, Ed. C8, 1749-016 Lisboa (Portugal); Goncalves, A.P. [Centro de Fisica da Materia Condensada, Universidade de Lisboa, Campo Grande, Ed. C8, 1749-016 Lisboa (Portugal); Departamento de Quimica, Instituto Tecnologico e Nuclear, P-2686-953 Sacavem (Portugal); Silva, R.C. da [Laboratorio de Feixe de Ioes, Dep. Fisica, Instituto Tecnologico e Nuclear, Estrada Nacional 10, 2686-953 Sacavem (Portugal); Centro de Fisica Nuclear da Universidade de Lisboa, Av. Prof. Gama Pinto 2, 1649-003 Lisboa (Portugal); Magalhaes, S. [Laboratorio de Feixe de Ioes, Dep. Fisica, Instituto Tecnologico e Nuclear, Estrada Nacional 10, 2686-953 Sacavem (Portugal); Lourenco, M.J.V.; Santos, F.J.V. [Centro de Ciencias Moleculares e Materiais, Faculdade de Ciencias da Universidade de Lisboa, Campo Grande, Ed. C8, 1749-016, Lisboa (Portugal); Departamento de Quimica e Bioquimica, Faculdade de Ciencias da Universidade de Lisboa, Campo Grande, Ed. C8, 1749-016 Lisboa (Portugal); Godinho, M. [Centro de Fisica da Materia Condensada, Universidade de Lisboa, Campo Grande, Ed. C8, 1749-016 Lisboa (Portugal); Dep. de Fisica, Faculdade de Ciencias, Universidade de Lisboa, Campo Grande, Ed. C8, 1749-016 Lisboa (Portugal)

    2009-05-01

    Thin films of CaO were grown on silicon (Si) and lanthanum aluminate (LaAlO{sub 3}) substrates by pulsed injection metal-organic chemical vapour deposition in a vertical injection MOCVD system. Growth parameters were systematically varied to study their effect on film growth and quality and to determine the optimal growth conditions for this material. Film quality and growth rate were evaluated by atomic force microscopy, X-ray diffraction and Rutherford Backscattering Spectroscopy measurements. Optimised conditions allowed growing transparent, single phase films textured along the (0 0 l) direction.

  5. Modelling mass transfer during venting/soil vapour extraction: Non-aqueous phase liquid/gas mass transfer coefficient estimation

    Science.gov (United States)

    Esrael, D.; Kacem, M.; Benadda, B.

    2017-07-01

    We investigate how the simulation of the venting/soil vapour extraction (SVE) process is affected by the mass transfer coefficient, using a model comprising five partial differential equations describing gas flow and mass conservation of phases and including an expression accounting for soil saturation conditions. In doing so, we test five previously reported quations for estimating the non-aqueous phase liquid (NAPL)/gas initial mass transfer coefficient and evaluate an expression that uses a reference NAPL saturation. Four venting/SVE experiments utilizing a sand column are performed with dry and non-saturated sand at low and high flow rates, and the obtained experimental results are subsequently simulated, revealing that hydrodynamic dispersion cannot be neglected in the estimation of the mass transfer coefficient, particularly in the case of low velocities. Among the tested models, only the analytical solution of a convection-dispersion equation and the equation proposed herein are suitable for correctly modelling the experimental results, with the developed model representing the best choice for correctly simulating the experimental results and the tailing part of the extracted gas concentration curve.

  6. Raman Spectroscopic Study of the Vapour Phase of 1-Methylimidazolium Ethanoate, a Protic Ionic Liquid

    DEFF Research Database (Denmark)

    Berg, Rolf W.; Canongia Lopes, Jose N.; Ferreira, Rui

    2010-01-01

    The gas phase over the ionic liquid 1-methylimidazolium ethanoate, [Hmim][O2CCH3], was studied by means of Raman spectroscopy. Raman spectra are presented, the species in the gas phase are identified, and their bands are assigned. The results are interpreted using ab initio quantum mechanical...... calculations that also predict vibrational spectra. The obtained data reinforce a previous interpretation, based on FT-ICR mass spectrometric data, that the vapor phase over [Hmim][O2CCH3] consists predominantly of two neutral molecules, monomeric ethanoic acid and 1-methylimidazole....

  7. Pyrolytic in situ magnetization of metal-organic framework MIL-100 for magnetic solid-phase extraction.

    Science.gov (United States)

    Huo, Shu-Hui; An, Hai-Yan; Yu, Jing; Mao, Xue-Feng; Zhang, Zhe; Bai, Lei; Huang, Yan-Feng; Zhou, Peng-Xin

    2017-09-29

    In this study, we report a facile, environmental friendly fabrication of a type of magnetic metal-organic framework (MOF) MIL-100 that can be used for magnetic solid-phase extraction (MSPE). The magnetic MOF composites were fabricated using in situ calcination method. The as-synthesized materials exhibited both high porosity and magnetic characteristics. They used for the MSPE of polycyclic aromatic hydrocarbons (PAHs) from water samples. Such MOF-based magnetic solid-phase extraction in combination with gas chromatography equipped with a flame ionization detector (GC-FID), exhibited wide linearity (0.02-250μgL -1 ), low detection limits (4.6-8.9ngL -1 ), and high enrichment factors (452-907) for PAHs. The relative standard deviations (RSDs) for intra- and inter-day extractions of PAHs were ranging from 1.7% to 9.8% and 3.8% to 9.2%, respectively. The recoveries for spiked PAHs (1μgL -1 ) in water samples were in the range of 88.5% to 106.6%. The results showed that the special anion-π orbital (electron donor-acceptor) interaction and π-π stacking between magnetic MIL-100 and PAHs play an important role in the adsorption of PAHs. Copyright © 2017. Published by Elsevier B.V.

  8. Online analytical investigations on solvent-, temperature- and water vapour-induced phase transformations of citric acid

    Energy Technology Data Exchange (ETDEWEB)

    Helmdach, L.; Ulrich, J. [Martin-Luther-Universitaet Halle-Wittenberg, Zentrum fuer Ingenieurwissenschaft, Verfahrenstechnik/TVT, Halle (Saale) (Germany); Feth, M.P. [Sanofi-Aventis Deutschland GmbH, Chemical and Process Development Frankfurt Chemistry, Frankfurt (Germany)

    2012-09-15

    It was demonstrated exemplarily for the crystallization of citric acid that the usage of an ultrasound device as well as Raman spectroscopy enables the inline measurement and the control of phase transitions. The influence of different solvent compositions (water and ethanol-water) on the crystallization of citric acid was investigated. By increasing the ethanol content the transformation point was shifted towards higher temperatures. In addition, a strong impact on the nucleation point as well as on the crystal habit was detected in ethanol-water mixtures. The results lead to the assumption that a citric acid solvate exists, which is, however, highly unstable upon isolation from mother liquor and converts fast into the known anhydrate or monohydrate forms of citric acid. The presence of such a solvate, however, could not be proven during this study. Furthermore, factors such as temperature and humidity which might influence the phase transition of the solid product were analyzed by Hotstage-Raman Spectroscopy and Water Vapor Sorption Gravimetry-Dispersive Raman Spectroscopy. Both, temperature as well as humidity show a strong influence on the behaviour of CAM. (Copyright copyright 2012 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  9. p and n-type germanium layers grown using iso-butyl germane in a III-V metal-organic vapor phase epitaxy reactor

    International Nuclear Information System (INIS)

    Jakomin, Roberto; Beaudoin, Gregoire; Gogneau, Noelle; Lamare, Bruno; Largeau, Ludovic; Mauguin, Olivia; Sagnes, Isabelle

    2011-01-01

    We report on the growth of n- and p-doped Germanium (Ge) on Ge substrates by Metal-Organic Vapor Phase Epitaxy (MOVPE). Iso-butyl germane, a liquid metal-organic source less toxic than Germane, is used as Ge precursor. We demonstrate the p-doping of Germanium by MOVPE using Trimethylgallium. The influence of the growth parameters for n and p-type doping is studied in order to optimize the morphology, the structural and the electrical properties of the Ge layers. The controlled growth of p and n doped Ge layers opens the possibility to realize totally epitaxially grown Ge diodes with improved performances, for example, for solar cell applications.

  10. Preparation and characterization of metal-organic framework MIL-101(Cr)-coated solid-phase microextraction fiber.

    Science.gov (United States)

    Xie, Lijun; Liu, Shuqin; Han, Zhubing; Jiang, Ruifen; Liu, Hong; Zhu, Fang; Zeng, Feng; Su, Chengyong; Ouyang, Gangfeng

    2015-01-01

    Metal-organic frameworks (MOFs) have received great attention as novel sorbents due to their fascinating structures and intriguing potential applications in various fields. In this work, a MIL-101(Cr)-coated solid-phase microextraction (SPME) fiber was fabricated by a simple direct coating method and applied to the determination of volatile compounds (BTEX, benzene, toluene, ethylbenzene, m-xylene and o-xylene) and semi-volatile compounds (PAHs, polycyclic aromatic hydrocarbons) from water samples. The extraction and desorption conditions of headspace SPME (HS-SPME) were optimized. Under the optimized conditions, the established methods exhibited excellent extraction performance. Good precision (<7.7%) and low detection limits (0.32-1.7 ng L(-1) and 0.12-2.1 ng L(-1) for BTEX and PAHs, respectively) were achieved. In addition, the MIL-101(Cr)-coated fiber possessed good thermal stability, and the fiber can be reused over 150 times. The fiber was successfully applied to the analysis of BTEX and PAHs in river water by coupling with gas chromatography-mass spectrometry (GC-MS). The analytes at low concentrations (1.7 and 10 ng L(-1)) were detected, and the recoveries obtained with the spiked river water samples were in the range of 80.0-113% and 84.8-106% for BTEX and PAHs, respectively, which demonstrated the applicability of the self-made fiber. Copyright © 2014 Elsevier B.V. All rights reserved.

  11. The effect of silicon doping on the lattice parameter of gallium arsenide grown by liqiud-phase epitaxy, vapour-phase epitaxy and gradient-freeze techniques

    International Nuclear Information System (INIS)

    Fewster, P.F.; Willoughby, A.F.W.

    1980-01-01

    An extensive study of lattice parameters of silicon doped gallium arsenide grown by liqiud-phase epitaxy, vapour-phase epitaxy and gradient-freeze techniques has been undertaken. Lattice parameters were measured by the Bond techniques to a precision of 1 ppm, and the material studied was also characterised independently for carrier concentration, carrier mobility, and in some cases, for silicon site distribution by infra-red LVM measurements. It is concluded that the p-type LPE layers show a very large lattice contraction compared with undoped material, while VPE and gradient-freeze material have parameters much closer to the undoped value. The lattice contraction in Si-doped LPE layers is about 6 x 10 -4 A at hole concentration levels of 6 x 10 18 cm -3 , and the contraction is roughly proportional to the free-hole concentration from 1 to 6 x 10 18 cm -3 . It is concluded that the p-type Si-doped LPE layers studied contain a high concentration of a contracting defect associated with silicon whose concentration is related to the free-hole concentration. The most likely defect responsible is Sisub(G)sub(a), present in high concentrations as a compensating donor, although other defects cannot be ruled out. (orig.)

  12. Major element and oxygen isotope geochemistry of vapour-phase garnet from the Topopah Spring Tuff at Yucca Mountain, Nevada, USA

    Science.gov (United States)

    Moscati, Richard J.; Johnson, Craig A.

    2014-01-01

    Twenty vapour-phase garnets were studied in two samples of the Topopah Spring Tuff of the Paintbrush Group from Yucca Mountain, in southern Nevada. The Miocene-age Topopah Spring Tuff is a 350 m thick, devitrified, moderately to densely welded ash-flow tuff that is zoned compositionally from high-silica rhyolite to latite. During cooling of the tuff, escaping vapour produced lithophysae (former gas cavities) lined with an assemblage of tridymite (commonly inverted to cristobalite or quartz), sanidine and locally, hematite and/or garnet. Vapour-phase topaz and economic deposits associated commonly with topaz-bearing rhyolites (characteristically enriched in F) were not found in the Topopah Spring Tuff at Yucca Mountain. Based on their occurrence only in lithophysae, the garnets are not primary igneous phenocrysts, but rather crystals that grew from a F-poor magma-derived vapour trapped during and after emplacement of the tuff. The garnets are euhedral, vitreous, reddish brown, trapezohedral, as large as 2 mm in diameter and fractured. The garnets also contain inclusions of tridymite. Electron microprobe analyses of the garnets reveal that they are almandine-spessartine (48.0 and 47.9 mol.%, respectively), have an average composition of (Fe1.46Mn1.45Mg0.03Ca0.10)(Al1.93Ti0.02)Si3.01O12 and are comparatively homogeneous in Fe and Mn concentrations from core to rim. Composited garnets from each sample site have δ18O values of 7.2 and 7.4‰. The associated quartz (after tridymite) has δ18O values of 17.4 and 17.6‰, values indicative of reaction with later, low-temperature water. Unaltered tridymite from higher in the stratigraphic section has a δ18O of 11.1‰ which, when coupled with the garnet δ18O values in a quartz-garnet fractionation equation, indicates isotopic equilibration (vapour-phase crystallization) at temperatures of ~600°C. This high-temperature mineralization, formed during cooling of the tuffs, is distinct from the later and commonly recognized

  13. RETRACTED: High quality N-polar GaN two-dimensional growth on c-plane sapphire by metalorganic vapor phase epitaxy

    Science.gov (United States)

    Zhang, Yuantao; Dong, Xin; Li, Guoxing; Li, Wancheng; Zhang, Baolin; Du, Guotong

    2013-03-01

    We report the growth of atomically smooth N-polar GaN on c-plane sapphire by metalorganic vapor phase epitaxy. A two-step growth technique was adopted; low-temperature growth of GaN buffer before high-temperature GaN growth. The complete two-dimensional N-polar GaN growth process was recorded by in situ reflectance. The phase composition of the low-temperature GaN was examined by X-ray diffraction pole figure measurements. The thickness of the low-temperature GaN buffer dramatically affected the crystalline and electronic properties of the N-polar GaN. A very small full width at half maximum for the (0 0 0 2) X-ray rocking curve, 51 arcs, was obtained for 700-nm-thick N-polarity GaN by optimizing the buffer thickness.

  14. Novel method for determining DDT in vapour and particulate phases within contaminated indoor air in a malaria area of South Africa

    Energy Technology Data Exchange (ETDEWEB)

    Naude, Yvette, E-mail: yvette.naude@up.ac.za [Department of Chemistry, University of Pretoria, Private Bag X20, Hatfield 0028, Pretoria (South Africa); Rohwer, Egmont R., E-mail: egmont.rohwer@up.ac.za [Department of Chemistry, University of Pretoria, Private Bag X20, Hatfield 0028, Pretoria (South Africa)

    2012-06-12

    Highlights: Black-Right-Pointing-Pointer We present a novel denuder for the determination of DDT in contaminated indoor air. Black-Right-Pointing-Pointer Single step concentration of vapour phase on PDMS, particulate phase on filter. Black-Right-Pointing-Pointer Solvent-free green technique, sample extraction not required. Black-Right-Pointing-Pointer Ratios of airborne p,p Prime -DDD/p,p Prime -DDT and of o,p Prime -DDT/p,p Prime -DDT are unusual. Black-Right-Pointing-Pointer Insecticidal efficacy of technical DDT may be compromised. - Abstract: The organochlorine insecticide DDT (1,1,1-trichloro-2,2-bis(p-chlorophenyl)ethane) is still used for malaria vector control in certain areas of South Africa. The strict Stockholm Convention on Persistent Organic Pollutants (POPs) allows spraying on the inside of traditional dwellings with DDT. In rural villages contaminated dust presents an additional pathway for exposure to DDT. We present a new method for the determination of DDT in indoor air where separate vapour and particulate samples are collected in a single step with a denuder configuration of a multi-channel open tubular silicone rubber (polydimethylsiloxane (PDMS)) trap combined with a micro quartz fibre filter. The multi-channel PDMS trap section of the denuder concentrates vapour phase insecticide whereas particle associated insecticide is transferred downstream where it is collected on a micro-fibre filter followed by a second multi-channel PDMS trap to capture the blow-off from the filter. The multi-channel PDMS trap and filter combination are designed to fit a commercial thermal desorber for direct introduction of samples into a GC-MS. The technique is solvent-free. Analyte extraction and sample clean-up is not required. Two fractions, vapour phase and particulate phase p,p Prime -DDT, o,p Prime -DDT; p,p Prime -DDD, o,p Prime -DDD; p,p Prime -DDE and o,p Prime -DDE in 4 L contaminated indoor air, were each quantitatively analysed by GC-MS using

  15. Novel method for determining DDT in vapour and particulate phases within contaminated indoor air in a malaria area of South Africa

    International Nuclear Information System (INIS)

    Naudé, Yvette; Rohwer, Egmont R.

    2012-01-01

    Highlights: ► We present a novel denuder for the determination of DDT in contaminated indoor air. ► Single step concentration of vapour phase on PDMS, particulate phase on filter. ► Solvent-free green technique, sample extraction not required. ► Ratios of airborne p,p′-DDD/p,p′-DDT and of o,p′-DDT/p,p′-DDT are unusual. ► Insecticidal efficacy of technical DDT may be compromised. - Abstract: The organochlorine insecticide DDT (1,1,1-trichloro-2,2-bis(p-chlorophenyl)ethane) is still used for malaria vector control in certain areas of South Africa. The strict Stockholm Convention on Persistent Organic Pollutants (POPs) allows spraying on the inside of traditional dwellings with DDT. In rural villages contaminated dust presents an additional pathway for exposure to DDT. We present a new method for the determination of DDT in indoor air where separate vapour and particulate samples are collected in a single step with a denuder configuration of a multi-channel open tubular silicone rubber (polydimethylsiloxane (PDMS)) trap combined with a micro quartz fibre filter. The multi-channel PDMS trap section of the denuder concentrates vapour phase insecticide whereas particle associated insecticide is transferred downstream where it is collected on a micro-fibre filter followed by a second multi-channel PDMS trap to capture the blow-off from the filter. The multi-channel PDMS trap and filter combination are designed to fit a commercial thermal desorber for direct introduction of samples into a GC–MS. The technique is solvent-free. Analyte extraction and sample clean-up is not required. Two fractions, vapour phase and particulate phase p,p′-DDT, o,p′-DDT; p,p′-DDD, o,p′-DDD; p,p′-DDE and o,p′-DDE in 4 L contaminated indoor air, were each quantitatively analysed by GC–MS using isotopically labelled ring substituted 13 C 12 –p,p′-DDT as an internal standard. Limits of detection were 0.07–0.35 ng m −3 for p,p′-DDT, o,p′-DDT, p

  16. An example of transition from a corrosion process in gaseous phase to corrosion in aqueous environment: the case of Z2CN18-10 stainless steel by iodine and water in vapour phase

    International Nuclear Information System (INIS)

    Mathieu, Bruno

    1990-01-01

    This research thesis addresses an example of transition of a corrosion process in gaseous phase towards corrosion in aqueous environment, specifically in the case of the corrosion of the Z2CN18-10 stainless steel by gaseous iodine in presence of water vapour (and possibly nitrogen dioxide). This transition occurs in two steps: initiation in gaseous phase and growth in aqueous environment. This transition is due to hygroscopic properties of mostly chromium iodides and, to a lesser extent, iron iodides. Morphological, electrochemical and thermogravimetry studies have been performed by varying different parameters governing corrosion processes: corrosion temperature, iodine concentration, relative humidity, and reaction time [fr

  17. Cadmium(II)-based metal-organic nanotubes as solid-phase microextraction coating for ultratrace-level analysis of polychlorinated biphenyls in seawater samples.

    Science.gov (United States)

    Sheng, Wan-Ru; Chen, Yue; Wang, Shan-Shan; Wang, Xiao-Li; Wang, Ming-Lin; Zhao, Ru-Song

    2016-11-01

    In this study, stable cadmium(II)-based metal-organic nanotubes (Cd-MONTs) were prepared and used as a coating material for solid-phase microextraction (SPME) of polychlorinated biphenyls (PCBs) from environmental water samples. The as-prepared Cd-MONT SPME coating material was characterized by thermal gravimetric analysis, scanning electron microscopy, and X-ray diffraction. The synthesized Cd-MONTs exhibited high thermal stability (385 °C) and excellent extraction performance toward PCBs. The important conditions were optimized systematically by the response surface method. Under the optimal conditions, the new fiber achieved high enrichment factors (938-3417), low limits of detection (1.80-8.73 pg L -1 ), and wide linearity (10-5000 pg L -1 ). The method developed was used in ultratrace-level analysis of PCBs in seawater samples, with satisfactory results for each sample.

  18. Deposition of Metal-Organic Frameworks by Liquid-Phase Epitaxy: The Influence of Substrate Functional Group Density on Film Orientation

    Science.gov (United States)

    Liu, Jinxuan; Shekhah, Osama; Stammer, Xia; Arslan, Hasan K.; Liu, Bo; Schüpbach, Björn; Terfort, Andreas; Wöll, Christof

    2012-01-01

    The liquid phase epitaxy (LPE) of the metal-organic framework (MOF) HKUST-1 has been studied for three different COOH-terminated templating organic surfaces prepared by the adsorption of self-assembled monolayers (SAMs) on gold substrates. Three different SAMs were used, mercaptohexadecanoic acid (MHDA), 4’-carboxyterphenyl-4-methanethiol (TPMTA) and 9-carboxy-10-(mercaptomethyl)triptycene (CMMT). The XRD data demonstrate that highly oriented HKUST-1 SURMOFs with an orientation along the (100) direction was obtained on MHDA-SAMs. In the case of the TPMTA-SAM, the quality of the deposited SURMOF films was found to be substantially inferior. Surprisingly, for the CMMT-SAMs, a different growth direction was obtained; XRD data reveal the deposition of highly oriented HKUST-1 SURMOFs grown along the (111) direction.

  19. Deposition of metal-organic frameworks by liquid-phase epitaxy: The influence of substrate functional group density on film orientation

    KAUST Repository

    Liu, J.

    2012-09-05

    The liquid phase epitaxy (LPE) of the metal-organic framework (MOF) HKUST-1 has been studied for three different COOH-terminated templating organic surfaces prepared by the adsorption of self-assembled monolayers (SAMs) on gold substrates. Three different SAMs were used, mercaptohexadecanoic acid (MHDA), 4\\'-carboxyterphenyl-4-methanethiol (TPMTA) and 9-carboxy-10-(mercaptomethyl)triptycene (CMMT). The XRD data demonstrate that highly oriented HKUST-1 SURMOFs with an orientation along the (100) direction was obtained on MHDA-SAMs. In the case of the TPMTA-SAM, the quality of the deposited SURMOF films was found to be substantially inferior. Surprisingly, for the CMMT-SAMs, a different growth direction was obtained; XRD data reveal the deposition of highly oriented HKUST-1 SURMOFs grown along the (111) direction.

  20. Deposition of Metal-Organic Frameworks by Liquid-Phase Epitaxy: The Influence of Substrate Functional Group Density on Film Orientation

    Directory of Open Access Journals (Sweden)

    Christof Wöll

    2012-09-01

    Full Text Available The liquid phase epitaxy (LPE of the metal-organic framework (MOF HKUST-1 has been studied for three different COOH-terminated templating organic surfaces prepared by the adsorption of self-assembled monolayers (SAMs on gold substrates. Three different SAMs were used, mercaptohexadecanoic acid (MHDA, 4’-carboxyterphenyl-4-methanethiol (TPMTA and 9-carboxy-10-(mercaptomethyltriptycene (CMMT. The XRD data demonstrate that highly oriented HKUST-1 SURMOFs with an orientation along the (100 direction was obtained on MHDA-SAMs. In the case of the TPMTA-SAM, the quality of the deposited SURMOF films was found to be substantially inferior. Surprisingly, for the CMMT-SAMs, a different growth direction was obtained; XRD data reveal the deposition of highly oriented HKUST-1 SURMOFs grown along the (111 direction.

  1. Physical-chemical and technological aspects of the preparation of think layers of the high temperature superconductors Bi-Sr-Ca-Cu-O by method of metal organic vapour phase epitaxy

    International Nuclear Information System (INIS)

    Stejskal, J.; Nevriva, M.; Leitner, J.

    1995-01-01

    The method of metal organic vapour phase epitaxy (MO VPE) was used for preparation of think layers of the high temperature superconductors Bi-Sr-Ca-Cu-O. The suitable chemical precursors (β-diketonates) on the literature data and of the own thermodynamic calculations were selected. The optimal thermodynamic data and thermodynamic stability of the prepared samples were determined

  2. Anti corrosion layer for stainless steel in molten carbonate fuel cell - comprises phase vapour deposition of titanium nitride, aluminium nitride or chromium nitride layer then oxidising layer in molten carbonate electrolyte

    DEFF Research Database (Denmark)

    2000-01-01

    Forming an anticorrosion protective layer on a stainless steel surface used in a molten carbonate fuel cell (MCFC) - comprises the phase vapour deposition (PVD) of a layer comprising at least one of titanium nitride, aluminium nitride or chromium nitride and then forming a protective layer in situ...

  3. Characterization of TiO{sub 2} thin films obtained by metal-organic chemical vapour deposition; Caracterizacao de filmes finos de TiO{sub 2} obtidos por deposicao quimica em fase vapor

    Energy Technology Data Exchange (ETDEWEB)

    Carriel, Rodrigo Crociati

    2015-07-01

    Titanium dioxide (TiO{sub 2}) thin films were grown on silicon substrate (100) by MOCVD process (chemical deposition of organometallic vapor phase). The films were grown at 400, 500, 600 and 700 ° C in a conventional horizontal equipment. Titanium tetraisopropoxide was used as source of both oxygen and titanium. Nitrogen was used as carrier and purge gas. X-ray diffraction technique was used for the characterization of the crystalline structure. Scanning electron microscopy with field emission gun was used to evaluate the morphology and thickness of the films. The films grown at 400 and 500°C presented anatase phase. The film grown at 600ºC presented rutile besides anatase phase, while the film grown at 700°C showed, in addition to anatase and rutile, brookite phase. In order to evaluate the electrochemical behavior of the films cyclic voltammetry technique was used. The tests revealed that the TiO2 films formed exclusively by the anatase phase exhibit strong capacitive character. The anodic current peak is directly proportional to the square root of the scanning rate for films grown at 500ºC, suggesting that linear diffusion is the predominant mechanism of cations transport. It was observed that in the film grown during 60 minutes the Na+ ions intercalation and deintercalation easily. The films grown in the other conditions did not present the anodic current peak, although charge was accumulated in the film. (author)

  4. Covalent Bonding of Metal-Organic Framework-5/Graphene Oxide Hybrid Composite to Stainless Steel Fiber for Solid-Phase Microextraction of Triazole Fungicides from Fruit and Vegetable Samples.

    Science.gov (United States)

    Zhang, Shuaihua; Yang, Qian; Wang, Wenchang; Wang, Chun; Wang, Zhi

    2016-04-06

    A hybrid material of the zinc-based metal-organic framework-5 and graphene oxide (metal-organic framework-5/graphene oxide) was prepared as a novel fiber coating material for solid-phase microextraction (SPME). The SPME fibers were fabricated by covalent bonding via chemical cross-linking between the coating material metal-organic framework-5/graphene oxide and stainless steel wire. The prepared fiber was used for the extraction of five triazole fungicides from fruit and vegetable samples. Gas chromatography coupled with microelectron capture detector (GC-μECD) was used for quantification. The developed method gave a low limit of detection (0.05-1.58 ng g(-1)) and good linearity (0.17-100 ng g(-1)) for the determination of the triazole fungicides in fruit and vegetable samples. The relative standard deviations (RSDs) for five replicate extractions of the triazole fungicides ranged from 3.7 to 8.9%. The method recoveries for spiked fungicides (5, 20, and 50 ng g(-1)) in grape, apple, cucumber, celery cabbage, pear, cabbage, and tomato samples were in the range of 85.6-105.8% with the RSDs ranging from 3.6 to 11.4%, respectively, depending on both the analytes and samples. The metal-organic framework-5/graphene oxide coated fiber was stable enough for 120 extraction cycles without a significant loss of extraction efficiency. The method was suitable for the determination of triazole fungicides in fruit and vegetable samples.

  5. The investigation on the vapour liquid phase equilibrium of (ammonia + 1,1,1,2-tetrafluoroethane) system over the temperatures ranging from (243.150 to 283.150) K

    International Nuclear Information System (INIS)

    Zhao, Yanxing; Dong, Xueqiang; Zhong, Quan; Gong, Maoqiong; Shen, Jun

    2017-01-01

    Highlights: • The vapour liquid equilibrium for ammonia + 1,1,1,2-tetrafluoroethane system was studied. • Measurements were based on vapour phase single recirculation method. • A positive azeotropic behaviour was exhibited at the experimental temperature range. - Abstract: To blend ammonia with some hydrofluorocarbons may give these mixed refrigerants lower flammability and global warming potential. In this paper, the isothermal vapour liquid equilibrium (VLE) of (ammonia + 1,1,1,2-tetrafluoroethane) system at temperatures ranging from (243.150 to 283.150) K are presented. Two models were employed to regress the experimental VLE results, namely the Peng–Robinson (PR) equation of state with the simple van der waals (VDW) mixing rule; the Peng–Robinson equation of state combined non-random two-liquid (NRTL) activity coefficient model with the modified Huron-Vidal one-order (MHV1) mixing rule. The maximum average absolute relative deviation of pressure (AARDp) and average absolute deviation of the vapour phase mole fraction (AADy) for PR-VDW are 0.56% and 0.010, respectively, while the maximum AARDp and AADy for PR-MHV1-NRTL are 0.27% and 0.014, respectively. Positive azeotropic behaviour was exhibited at each temperature investigated.

  6. Global phase equilibrium calculations: Critical lines, critical end points and liquid-liquid-vapour equilibrium in binary mixtures

    DEFF Research Database (Denmark)

    Cismondi, Martin; Michelsen, Michael Locht

    2007-01-01

    A general strategy for global phase equilibrium calculations (GPEC) in binary mixtures is presented in this work along with specific methods for calculation of the different parts involved. A Newton procedure using composition, temperature and Volume as independent variables is used for calculati...

  7. Growth of non-polar (11-20 InGaN quantum dots by metal organic vapour phase epitaxy using a two temperature method

    Directory of Open Access Journals (Sweden)

    J. T. Griffiths

    2014-12-01

    Full Text Available Non-polar (11-20 InGaN quantum dots (QDs were grown by metal organic vapour phase epitaxy. An InGaN epilayer was grown and subjected to a temperature ramp in a nitrogen and ammonia environment before the growth of the GaN capping layer. Uncapped structures with and without the temperature ramp were grown for reference and imaged by atomic force microscopy. Micro-photoluminescence studies reveal the presence of resolution limited peaks with a linewidth of less than ∼500 μeV at 4.2 K. This linewidth is significantly narrower than that of non-polar InGaN quantum dots grown by alternate methods and may be indicative of reduced spectral diffusion. Time resolved photoluminescence studies reveal a mono-exponential exciton decay with a lifetime of 533 ps at 2.70 eV. The excitonic lifetime is more than an order of magnitude shorter than that for previously studied polar quantum dots and suggests the suppression of the internal electric field. Cathodoluminescence studies show the spatial distribution of the quantum dots and resolution limited spectral peaks at 18 K.

  8. In-situ Fourier transform infrared spectroscopy gas phase studies of vanadium (IV) oxide coating by atmospheric pressure chemical vapour deposition using vanadyl (IV) acetylacetonate

    Energy Technology Data Exchange (ETDEWEB)

    Vernardou, D. [Institute for Materials Research, University of Salford, Cockroft Building, Salford, Manchester, M5 4WT (United Kingdom); Pemble, M.E. [Tyndall National institute, Lee Maltings, Prospect Row, Cork (Ireland)], E-mail: martyn.pemble@tyndall.ie; Sheel, D.W. [Institute for Materials Research, University of Salford, Cockroft Building, Salford, Manchester, M5 4WT (United Kingdom)

    2008-05-30

    This paper describes the use of in-situ Fourier transform infrared spectroscopy to monitor the gas phase reactions of the formation of VO{sub 2} thin films from VO(acac){sub 2} under atmospheric pressure chemical vapour deposition conditions. In the absence of O{sub 2}, it is found that anhydride species may form, while there is also some evidence of ester species. In the presence of O{sub 2}, the spectra obtained are almost identical to those in the absence of O{sub 2}. However in this case, there is also some indication for the enhanced production of CO and the suppression of the formation of C-H species. A possible mechanism for the formation of VO{sub 2} is proposed, which involves the release of two C{sub 3}H{sub 4} molecules and the decomposition of vanadyl (IV) acetylacetonate into VO(CH{sub 3}COO){sub 2}, which then further decomposes to yield (CH{sub 3}CO){sub 2}O and VO{sub 2}. However, while spectroscopic evidence for the formation of these species is presented, the mechanism proposed cannot be confirmed on the basis of these data alone.

  9. Short overview on the definitions and significance of the late phase fission product aerosol/vapour source

    International Nuclear Information System (INIS)

    Sugimoto, J.; Kajimoto, M.; Hashimoto, K.; Soda, K.

    1994-09-01

    Fission product once deposited on the surface structure or dissolved in the water in a containment may be resuspended and/or re-vaporized and/or re-entrained during the course of a severe accident. These phenomena are supposed to take place in several situations such as rapid pressure decrease due to the containment failure or containment venting, or hydrogen combustion in containment. The mechanism of resuspension, revaporization or re-entrainment is either hydraulic, thermal, chemical or both. These phenomena, generally referred as 'resuspension' would pose some safety concern on a long-term release of fission products to the environment. This late phase fission product aerosol/vapor release was placed as one of unresolved issues in the analysis of severe accident phenomena, since this additional fission product source at or near the time of containment failure might reduce the benefits gained by delayed failure of the containment. The present paper gives an overview on the definition and significance of the late phase aerosol/vapor fission product source in severe accident condition, at the light of the various experimental and analytical efforts conducted to understand these phenomena

  10. High-temperature heat pump, phase 1: using a compressor with a vapour injection port; Pompe a chaleur haute temperature, phase 1: solution avec compresseur a injection vapeur

    Energy Technology Data Exchange (ETDEWEB)

    Brand, F.; Zehnder, M.; Favrat, D.

    2000-07-01

    The High Temperature Heat Pump project aims at developing an air-to-water heat pump that can replace a gas or fuel boiler in a house. To reach this goal, the heat pump must be able to produce domestic hot water at high temperature to allow the house's network to properly operate. A first objective is to produce hot water at 65 {sup o}C. A first prototype has been developed, starting from one of the most efficient heat pumps on the market. The pump was modified so as to function with a prototype compressor equipped with a vapour injection port. A series of tests highlighted not only the performance improvements due to the vapour injection but also the increase of the operation range of the heat pump and the optimal operating range of the injection. In terms of the coefficient of performance (COP) the gain increases with the reduction in temperature of the intake air; the improvement is on an average 13% in the operating range tested. With an ambient-air temperature of -12 {sup o}C it is possible to obtain hot water at 65 {sup o}C, whereas without injection the intake air must be at least 2 {sup o}C to reach the same water temperature. An average gain of 25% is obtained by injection for hot power. For measurement with de-icing, point A2/W50 with an optimal injection makes it possible to obtain a COP of 2.7 with a hot power of 9.4 kW. The defrosting cycle analysis makes possible to expect an improvement of these performances by optimisation and adjustment of the heat pump parameters. A thermostatic valve, whose probe is placed at the compressor output, controls the injection. It makes it possible to obtain an optimal operation for flows injected. Measurement results support a theoretical analysis of the whole installation and in particular of the compressor with injection port. This analysis will be used within the framework of a more detailed thermo economic heat pump study. (author)

  11. An unstructured finite volume solver for two phase water/vapour flows based on an elliptic oriented fractional step method

    International Nuclear Information System (INIS)

    Mechitoua, N.; Boucker, M.; Lavieville, J.; Pigny, S.; Serre, G.

    2003-01-01

    Based on experience gained at EDF and Cea, a more general and robust 3-dimensional (3D) multiphase flow solver has been being currently developed for over three years. This solver, based on an elliptic oriented fractional step approach, is able to simulate multicomponent/multiphase flows. Discretization follows a 3D full unstructured finite volume approach, with a collocated arrangement of all variables. The non linear behaviour between pressure and volume fractions and a symmetric treatment of all fields are taken into account in the iterative procedure, within the time step. It greatly enforces the realizability of volume fractions (i.e 0 < α < 1), without artificial numerical needs. Applications to widespread test cases as static sedimentation, water hammer and phase separation are shown to assess the accuracy and the robustness of the flow solver in different flow conditions, encountered in nuclear reactors pipes. (authors)

  12. High growth rate GaN on 200 mm silicon by metal-organic vapor phase epitaxy for high electron mobility transistors

    Science.gov (United States)

    Charles, M.; Baines, Y.; Bavard, A.; Bouveyron, R.

    2018-02-01

    It is increasingly important to reduce the cycle time of epitaxial growth, in order to reduce the costs of device fabrication, especially for GaN based structures which typically have growth cycles of several hours. We have performed a comprehensive study using metal-organic vapor phase epitaxy (MOVPE) investigating the effects of changing GaN growth rates from 0.9 to 14.5 μm/h. Although there is no significant effect on the strain incorporated in the layers, we have seen changes in the surface morphology which can be related to the change in dislocation behaviour and surface diffusion effects. At the small scale, as seen by AFM, increased dislocation density for higher growth rates leads to increased pinning of growth terraces, resulting in more closely spaced terraces. At a larger scale of hundreds of μm observed by optical profiling, we have related the formation of grains to the rate of surface diffusion of adatoms using a random walk model, implying diffusion distances from 30 μm for the highest growth rates up to 100 μm for the lowest. The increased growth rate also increases the intrinsic carbon incorporation which can increase the breakdown voltage of GaN films. Despite an increased threading dislocation density, these very high growth rates of 14.5 μm/hr by MOVPE have been shown to be appealing for reducing epitaxial growth cycle times and therefore costs in High Electron Mobility Transistor (HEMT) structures.

  13. A novel dispersive solid-phase extraction method using metal-organic framework MIL-101 as the adsorbent for the analysis of benzophenones in toner.

    Science.gov (United States)

    Li, Ning; Zhu, Quanfei; Yang, Yang; Huang, Jianlin; Dang, Xueping; Chen, Huaixia

    2015-01-01

    Metal-organic frameworks (MOFs) have been paid widespread attention in the field of adsorption and separation materials due to its porosity, large specific surface area, unsaturated metal-ligand sites and structural diversity. In this study, the green powder MIL-101 was synthesized and used for the extraction of benzophenone, 2,4-dihydroxybenzophenone and 2-hydroxy-4-methoxy-benzophenone from toner samples for the first time. The synthesized MIL-101 was characterized by X-ray diffraction, scanning electron microscopy, thermogravimetry and nitrogen adsorption porosimetry. The MIL-101 was applied as the dispersive solid phase extraction (DSPE) adsorbent for the extraction and preconcentration of benzophenone, 2,4-dihydroxybenzophenone and 2-hydroxy-4-methoxy-benzophenone from toner samples. The extraction conditions were investigated. Under the optimized conditions, a DSPE-HPLC method for the determination of benzophenone, 2,4-dihydroxybenzophenone and 2-hydroxy-4-methoxy-benzophenone was developed. The method yielded a linear calibration curve in the concentration ranges from 4.0 to 3500 μg L(-1) for the three analytes in toner samples with regression coefficients (r(2)) of 0.9992, 0.9999 and 0.9990, respectively. Limits of detection were 1.2, 1.2 and 0.9 μg L(-1), respectively. Both the intra-day and inter-day precisions (RSDs) were <10%. Copyright © 2014 Elsevier B.V. All rights reserved.

  14. Growth of InGaAs nanowires on Ge(111) by selective-area metal-organic vapor-phase epitaxy

    Science.gov (United States)

    Yoshida, Akinobu; Tomioka, Katsuhiro; Ishizaka, Fumiya; Motohisa, Junichi

    2017-04-01

    We report the growth of InGaAs nanowires (NWs) on Ge(111) substrates using selective-area metal-organic vapor-phase epitaxy (SA-MOVPE) for novel InGaAs/Ge hybrid complementary metal-oxide-semiconductor (CMOS) applications. Ge(111) substrates with periodic arrays of mask opening were prepared, and InGaAs was selectively grown on the opening region of Ge(111). A uniform array of InGaAs NWs with a diameter around 100 nm was successfully grown using appropriate preparation of the initial surfaces with an AsH3 thermal treatment and flow-rate modulation epitaxy (FME). We found that optimizing partial pressure of AsH3 and the number of FME cycles improved the yield of vertical InGaAs NWs. Line-scan profile analysis of energy dispersive X-ray (EDX) spectrometry showed that the In composition in the InGaAs NW was almost constant from the bottom to the top. Transmission electron microscope (TEM) analysis revealed that the interface between InGaAs NW and Ge had misfit dislocations, but their distance was longer than that expected from the difference in their lattice constants.

  15. Influence of incoherent twin boundaries on the electrical properties of β-Ga2O3 layers homoepitaxially grown by metal-organic vapor phase epitaxy

    Science.gov (United States)

    Fiedler, A.; Schewski, R.; Baldini, M.; Galazka, Z.; Wagner, G.; Albrecht, M.; Irmscher, K.

    2017-10-01

    We present a quantitative model that addresses the influence of incoherent twin boundaries on the electrical properties in β-Ga2O3. This model can explain the mobility collapse below a threshold electron concentration of 1 × 1018 cm-3 as well as partly the low doping efficiency in β-Ga2O3 layers grown homoepitaxially by metal-organic vapor phase epitaxy on (100) substrates of only slight off-orientation. A structural analysis by transmission electron microscopy (TEM) reveals a high density of twin lamellae in these layers. In contrast to the coherent twin boundaries parallel to the (100) plane, the lateral incoherent twin boundaries exhibit one dangling bond per unit cell that acts as an acceptor-like electron trap. Since the twin lamellae are thin, we consider the incoherent twin boundaries to be line defects with a density of 1011-1012 cm-2 as determined by TEM. We estimate the influence of the incoherent twin boundaries on the electrical transport properties by adapting Read's model of charged dislocations. Our calculations quantitatively confirm that the mobility reduction and collapse as well as partly the compensation are due to the presence of twin lamellae.

  16. Oriented circular dichroism analysis of chiral surface-anchored metal-organic frameworks grown by liquid-phase epitaxy and upon loading with chiral guest compounds

    KAUST Repository

    Gu, Zhigang

    2014-06-17

    Oriented circular dichroism (OCD) is explored and successfully applied to investigate chiral surface-anchored metal-organic frameworks (SURMOFs) based on camphoric acid (D- and Lcam) with the composition [Cu2(Dcam) 2x(Lcam)2-2x(dabco)]n (dabco=1,4-diazabicyclo- [2.2.2]-octane). The three-dimensional chiral SURMOFs with high-quality orientation were grown on quartz glass plates by using a layer-by-layer liquid-phase epitaxy method. The growth orientation, as determined by X-ray diffraction (XRD), could be switched between the [001] and [110] direction by using either OH- or COOH-terminated substrates. These SURMOFs were characterized by using OCD, which confirmed the ratio as well as the orientation of the enantiomeric linker molecules. Theoretical computations demonstrate that the OCD band intensities of the enantiopure [Cu2(Dcam)2(dabco)] n grown in different orientations are a direct result of the anisotropic nature of the chiral SURMOFs. Finally, the enantiopure [Cu 2(Dcam)2(dabco)]n and [Cu2(Lcam) 2(dabco)]n SURMOFs were loaded with the two chiral forms of ethyl lactate [(+)-ethyl-D-lactate and (-)-ethyl-L-lactate)]. An enantioselective enrichment of >60 % was observed by OCD when the chiral host scaffold was loaded from the racemic mixture. © 2014 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  17. Experimental and numerical study of two-phase flows at the inlet of evaporators in vapour compression cycles; Etude experimentale et numerique d'ecoulements diphasiques a l'entree des evaporateurs de cycles thermodynamiques

    Energy Technology Data Exchange (ETDEWEB)

    Ahmad, M

    2007-09-15

    Maldistribution of liquid-vapour two phase flows causes a significant decrease of the thermal and hydraulic performance of evaporators in thermodynamic vapour compression cycles. A first experimental installation was used to visualize the two phase flow evolution between the expansion valve and the evaporator inlet. A second experimental set-up simulating a compact heat exchanger has been designed to identify the functional and geometrical parameters creating the best distribution of the two phases in the different channels. An analysis and a comprehension of the relation between the geometrical and functional parameters with the flow pattern inside the header and the two phase distribution, has been established. A numerical simulations of a stratified flow and a stratified jet flow have been carried out using two CFD codes: FLUENT and NEPTUNE. In the case of a fragmented jet configuration, a global definition of the interfacial area concentration for a separated phases and dispersed phases flow has been established and a model calculating the fragmented mass fraction has been developed. (author)

  18. Photoreflectance study of strained GaAsN/GaAs T-junction quantum wires grown by metal-organic vapor phase epitaxy.

    Science.gov (United States)

    Klangtakai, Pawinee; Sanorpim, Sakuntam; Onabe, Kentaro

    2011-12-01

    Strained GaAsN T-junction quantum wires (T-QWRs) with different N contents grown on GaAs by two steps metal-organic vapor phase epitaxy in [001] and [110] directions, namely QW1 and QW2 respectively, have been investigated by photoreflectance (PR) spectroscopy. Two GaAsN T-QWRs with different N contents were formed by T-intersection of (i) a 6.4-nm-thick GaAs0.89N0.011 QW1 and a 5.2-nm-thick GaAs0.968N0.032 QW2 and (ii) a 5.0-nm-thick GaAs0.985N0.015 QW1 and a 5.2-nm-thick GaAs0.968N0.032 QW2. An evidence of a one-dimensional structure at T-intersection of the two QWs on the (001) and (110) surfaces was established by PR resonances associated with extended states in all the QW and T-QWR samples. It is found that larger lateral confinement energy than 100 meV in both of [001] and [110] directions were achieved for GaAsN T-QWRs. With increasing temperature, the transition energy of GaAsN T-QWRs decreases with a faster shrinking rate compared to that of bulk GaAs. Optical quality of GaAsN T-QWRs is found to be affected by the N-induced band edge fluctuation, which is the unique characteristic of dilute III-V-nitrides.

  19. Fabrication of a polymeric composite incorporating metal-organic framework nanosheets for solid-phase microextraction of polycyclic aromatic hydrocarbons from water samples

    Energy Technology Data Exchange (ETDEWEB)

    Wei, Songbo; Lin, Wei; Xu, Jianqiao [MOE Key Laboratory of Aquatic Product of Safety/KLGHEI of Environment and Energy Chemistry, School of Chemistry, Sun Yat-sen University, Guangzhou 510275 (China); Wang, Ying [School of Pharmacy, Guiyang Medical University, Guiyang 550004 (China); Liu, Shuqin; Zhu, Fang [MOE Key Laboratory of Aquatic Product of Safety/KLGHEI of Environment and Energy Chemistry, School of Chemistry, Sun Yat-sen University, Guangzhou 510275 (China); Liu, Yuan, E-mail: yliu@shou.edu.cn [College of Food Science & Technology, Shanghai Ocean University, Shanghai 201306 (China); Ouyang, Gangfeng, E-mail: cesoygf@mail.sysu.edu.cn [MOE Key Laboratory of Aquatic Product of Safety/KLGHEI of Environment and Energy Chemistry, School of Chemistry, Sun Yat-sen University, Guangzhou 510275 (China)

    2017-06-08

    In this contribution, it was discovered that even distribution of a metal-organic framework (MOF) [e.g. copper 1,4-benzenedicarboxylate (CBDC)] within polymeric matrixes (e.g. polyimide) resulted in a high-efficient coating material on the surface of a stainless steel wire (SSW). Consequently, a home-made solid phase microextraction (SPME) fiber was fabricated for fast determination of target analytes in real water samples. Scanning electron microscope images indicated that the coating possessed homogenously porous surface. Coupled with gas chromatography-mass spectrometry (GC-MS) and direct immersion SPME (DI-SPME) technique, the fiber was evaluated through the analysis of five polycyclic aromatic hydrocarbons (PAHs) in aqueous samples. Under optimized extraction and desorption conditions, the established method based on the home-made fiber exhibited good repeatability (4.2–12.7%, n = 6) and reproducibility (0.9–11.7%, n = 3), low limits of detection (LODs, 0.11–2.10 ng L{sup −1}), low limits of quantification (LOQs, 0.36–6.99 ng L{sup −1}) and wide linear ranges (20–5000 ng L{sup −1}). Eventually, the method was proven applicable in the determination of PAHs in real samples, as the recoveries were in a satisfactory range (81.7–116%). - Highlights: • A homogenously porous CBDC@polyimide-coated fiber was fabricated and characterized. • The fiber exhibited highly desired extraction performance towards PAHs. • The fiber was employed for the determination of PAHs in real aqueous samples.

  20. Fabrication of a polymeric composite incorporating metal-organic framework nanosheets for solid-phase microextraction of polycyclic aromatic hydrocarbons from water samples

    International Nuclear Information System (INIS)

    Wei, Songbo; Lin, Wei; Xu, Jianqiao; Wang, Ying; Liu, Shuqin; Zhu, Fang; Liu, Yuan; Ouyang, Gangfeng

    2017-01-01

    In this contribution, it was discovered that even distribution of a metal-organic framework (MOF) [e.g. copper 1,4-benzenedicarboxylate (CBDC)] within polymeric matrixes (e.g. polyimide) resulted in a high-efficient coating material on the surface of a stainless steel wire (SSW). Consequently, a home-made solid phase microextraction (SPME) fiber was fabricated for fast determination of target analytes in real water samples. Scanning electron microscope images indicated that the coating possessed homogenously porous surface. Coupled with gas chromatography-mass spectrometry (GC-MS) and direct immersion SPME (DI-SPME) technique, the fiber was evaluated through the analysis of five polycyclic aromatic hydrocarbons (PAHs) in aqueous samples. Under optimized extraction and desorption conditions, the established method based on the home-made fiber exhibited good repeatability (4.2–12.7%, n = 6) and reproducibility (0.9–11.7%, n = 3), low limits of detection (LODs, 0.11–2.10 ng L −1 ), low limits of quantification (LOQs, 0.36–6.99 ng L −1 ) and wide linear ranges (20–5000 ng L −1 ). Eventually, the method was proven applicable in the determination of PAHs in real samples, as the recoveries were in a satisfactory range (81.7–116%). - Highlights: • A homogenously porous CBDC@polyimide-coated fiber was fabricated and characterized. • The fiber exhibited highly desired extraction performance towards PAHs. • The fiber was employed for the determination of PAHs in real aqueous samples.

  1. Thermal desorption comprehensive two-dimensional gas chromatography coupled to time of flight mass spectrometry for vapour phase mainstream tobacco smoke analysis.

    Science.gov (United States)

    Savareear, Benjamin; Brokl, Michał; Wright, Chris; Focant, Jean-Francois

    2017-11-24

    A thermal desorption comprehensive two-dimensional gas chromatography coupled to time-of-flight mass spectrometry (TD-GC×GC-TOFMS) method has been developed for the analysis of mainstream tobacco smoke (MTS) vapour phase (VP). The selection process of the sample introduction approach involved comparing the results obtained from three different approaches: a) use of gas sampling bag followed by SPME (Tedlar ® -SPME), b) gas sampling bag followed by TD (Tedlar ® -TD), and c) sampling directly on TD sorbents (Direct-TD). Six different SPME fibers and six different TD sorbent beds were evaluated for the extraction capacities in terms of total number of peaks and related intensities or peak areas. The best results were obtained for the Direct-TD approach using Tenax TA/Carbograph1TD/Carboxen1003 sorbent tubes. The optimisation of TD tube desorption parameters was carried out using a face-centered central composite experimental design and resulted in the use of the Tenax TA/Carbograph 1TD/Carboxen 1003 sorbent with a 7.5min desorption time, a 60mL/min tube desorption flow, and a 250°C tube desorption temperature. The optimised method was applied to the separation of MTS-VP constituents, with 665 analytes detected. The method precision ranged from 1% to 15% for over 99% of identified peak areas and from 0% to 3% and 0% to 1% for both first ( 1 t R ) and second ( 2 t R ) dimension retention times, respectively. The method was applied to the analyses of two cigarette types differing in their filter construction. Principal component analysis (PCA) allowed a clear differentiation of the studied cigarette types (PC1 describing 94% of the explained variance). Supervised Fisher ratio analysis permitted the identification of compounds responsible for the chemical differences between the two sample types. A set of 91 most relevant compounds was selected by applying a Fisher ratio cut-off approach and most of them were selectively removed by one of the cigarette filter types

  2. Stabilization of Leidenfrost vapour layer by textured superhydrophobic surfaces.

    Science.gov (United States)

    Vakarelski, Ivan U; Patankar, Neelesh A; Marston, Jeremy O; Chan, Derek Y C; Thoroddsen, Sigurdur T

    2012-09-13

    In 1756, Leidenfrost observed that water drops skittered on a sufficiently hot skillet, owing to levitation by an evaporative vapour film. Such films are stable only when the hot surface is above a critical temperature, and are a central phenomenon in boiling. In this so-called Leidenfrost regime, the low thermal conductivity of the vapour layer inhibits heat transfer between the hot surface and the liquid. When the temperature of the cooling surface drops below the critical temperature, the vapour film collapses and the system enters a nucleate-boiling regime, which can result in vapour explosions that are particularly detrimental in certain contexts, such as in nuclear power plants. The presence of these vapour films can also reduce liquid-solid drag. Here we show how vapour film collapse can be completely suppressed at textured superhydrophobic surfaces. At a smooth hydrophobic surface, the vapour film still collapses on cooling, albeit at a reduced critical temperature, and the system switches explosively to nucleate boiling. In contrast, at textured, superhydrophobic surfaces, the vapour layer gradually relaxes until the surface is completely cooled, without exhibiting a nucleate-boiling phase. This result demonstrates that topological texture on superhydrophobic materials is critical in stabilizing the vapour layer and thus in controlling--by heat transfer--the liquid-gas phase transition at hot surfaces. This concept can potentially be applied to control other phase transitions, such as ice or frost formation, and to the design of low-drag surfaces at which the vapour phase is stabilized in the grooves of textures without heating.

  3. Stabilization of Leidenfrost vapour layer by textured superhydrophobic surfaces

    KAUST Repository

    Vakarelski, Ivan Uriev

    2012-09-12

    In 1756, Leidenfrost observed that water drops skittered on a sufficiently hot skillet, owing to levitation by an evaporative vapour film. Such films are stable only when the hot surface is above a critical temperature, and are a central phenomenon in boiling. In this so-called Leidenfrost regime, the low thermal conductivity of the vapour layer inhibits heat transfer between the hot surface and the liquid. When the temperature of the cooling surface drops below the critical temperature, the vapour film collapses and the system enters a nucleate-boiling regime, which can result in vapour explosions that are particularly detrimental in certain contexts, such as in nuclear power plants. The presence of these vapour films can also reduce liquid-solid drag. Here we show how vapour film collapse can be completely suppressed at textured superhydrophobic surfaces. At a smooth hydrophobic surface, the vapour film still collapses on cooling, albeit at a reduced critical temperature, and the system switches explosively to nucleate boiling. In contrast, at textured, superhydrophobic surfaces, the vapour layer gradually relaxes until the surface is completely cooled, without exhibiting a nucleate-boiling phase. This result demonstrates that topological texture on superhydrophobic materials is critical in stabilizing the vapour layer and thus in controlling-by heat transfer-the liquid-gas phase transition at hot surfaces. This concept can potentially be applied to control other phase transitions, such as ice or frost formation, and to the design of low-drag surfaces at which the vapour phase is stabilized in the grooves of textures without heating. © 2012 Macmillan Publishers Limited. All rights reserved.

  4. Phase transformation during simultaneous chalcogenization of CuIn(S,Se){sub 2} thin films using metalorganic sources

    Energy Technology Data Exchange (ETDEWEB)

    Shoji, Ryuki; Kayama, Yoshiki; Sugiyama, Mutsumi [Department of Electrical Engineering, Faculty of Science and Technology, Tokyo University of Science, 2641 Yamazaki, Noda 278-8510 (Japan); Chichibu, Shigefusa F. [Institute of Multidisciplinary Research for Advanced Materials, Tohoku University, 2-1-1 Katahira, Aoba, Sendai 980-8577 (Japan)

    2017-06-15

    Simultaneous chalcogenization of CuIn(S{sub y},Se{sub 1-y}){sub 2} (CISSe) thin films has been demonstrated using organometallic sources such as diethylselenide [(C{sub 2}H{sub 5}){sub 2}Se] and ditertiarybutylsulfide [(t-C{sub 4}H{sub 9}){sub 2}S] to obtain homogeneous CISSe pseudobinary alloys with controlled amounts of Se and S species. Low-temperature chalcogenization at 300 C resulted in the formation of Cu-SSe and In-SSe alloys diffused into the Cu{sub 11}In{sub 9} metallic precursor. On the other hand, high-temperature chalcogenization produced CISSe thin films without additional phases. The obtained results can be used for elucidating the mechanism of simultaneous chalcogenization and development of high-performance and cost-effective commercial applications. (copyright 2017 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

  5. Growth of gallium nitride based devices on silicon(001) substrates by metalorganic vapor phase epitaxy; Wachstum von Galliumnitrid-basierten Bauelementen auf Silizium(001)-Substraten mittels metallorganischer Gasphasenepitaxie

    Energy Technology Data Exchange (ETDEWEB)

    Reiher, Fabian

    2009-02-25

    The main topic of this thesis is to investigate GaN-based layer systems grown by metalorganic vapor phase epitaxy on Si(001) substrates. A temperature shift up to 45 K is measured for a complete device structure on a 2-inch silicon substrate. By using a 40 nm thin LT-AlN-seed layer (680 C), the GaN crystallites on Si(001) substrates are almost oriented with their GaN(10 anti 12)-planes parallel to the Si(001)-plane. A four-fold azimuthal symmetry occurs for these layers, with the GaN[10 anti 11]-direction is aligned parallel to one of the four equivalent left angle 110 right angle -directions, respectively. However, a mono-crystalline and fully coalesced GaN-layer with this crystallographic orientation could not yet been obtained. If a deposition temperature of more than 1100 C is used for the AlN-seed layer, solely the GaN[0001]- growth direction of crystallites occurs in the main GaN layer on Si(001) substrates. These c-axis oriented GaN columns feature two opposite azimuthal alignments that are rotated by 90 with respect to each other and with GaN[11 anti 20] parallel Si[110] and GaN[10 anti 10] parallel Si[110], respectively. By using 4 off-oriented substrates towards the Si[110]-direction, one certain azimuthal texture component can be selected. The critical value of the miscut angle corresponds to theoretical calculations predicting the occurrence of atomic double steps on the Si(001) surface. The achieved crystallographic quality of the GaN layers on Si(001) is characterized by having a tilt of FWHM=0.27 and a twist of FWHM=0.8 of the crystallites, determined by X-ray diffraction. A completely crack-free, up to 2.5 {mu}m thick, and mono-crystalline GaN-template can be realized on Si(001), integrating 4 or 5 LT-AlN-interlayers in the GaN buffer structure. Based on this structure, the first successful implementation of an (InGaN/GaN)-LED on Si(001) is achieved. Furthermore, the possible fabrication of GaN-based FET-structures is demonstrated with a fully

  6. Submicrometric Magnetic Nanoporous Carbons Derived from Metal-Organic Frameworks Enabling Automated Electromagnet-Assisted Online Solid-Phase Extraction.

    Science.gov (United States)

    Frizzarin, Rejane M; Palomino Cabello, Carlos; Bauzà, Maria Del Mar; Portugal, Lindomar A; Maya, Fernando; Cerdà, Víctor; Estela, José M; Turnes Palomino, Gemma

    2016-07-19

    We present the first application of submicrometric magnetic nanoporous carbons (μMNPCs) as sorbents for automated solid-phase extraction (SPE). Small zeolitic imidazolate framework-67 crystals are obtained at room temperature and directly carbonized under an inert atmosphere to obtain submicrometric nanoporous carbons containing magnetic cobalt nanoparticles. The μMNPCs have a high contact area, high stability, and their preparation is simple and cost-effective. The prepared μMNPCs are exploited as sorbents in a microcolumn format in a sequential injection analysis (SIA) system with online spectrophotometric detection, which includes a specially designed three-dimensional (3D)-printed holder containing an automatically actuated electromagnet. The combined action of permanent magnets and an automatically actuated electromagnet enabled the movement of the solid bed of particles inside the microcolumn, preventing their aggregation, increasing the versatility of the system, and increasing the preconcentration efficiency. The method was optimized using a full factorial design and Doehlert Matrix. The developed system was applied to the determination of anionic surfactants, exploiting the retention of the ion-pairs formed with Methylene Blue on the μMNPC. Using sodium dodecyl sulfate as a model analyte, quantification was linear from 50 to 1000 μg L(-1), and the detection limit was equal to 17.5 μg L(-1), the coefficient of variation (n = 8; 100 μg L(-1)) was 2.7%, and the analysis throughput was 13 h(-1). The developed approach was applied to the determination of anionic surfactants in water samples (natural water, groundwater, and wastewater), yielding recoveries of 93% to 110% (95% confidence level).

  7. Preparation of hydrosol suspensions of elemental and core–shell nanoparticles by co-deposition with water vapour from the gas-phase in ultra-high vacuum conditions

    International Nuclear Information System (INIS)

    Binns, Chris; Prieto, Pilar; Baker, Stephen; Howes, Paul; Dondi, Ruggero; Burley, Glenn; Lari, Leonardo; Kröger, Roland; Pratt, Andrew; Aktas, Sitki; Mellon, John K.

    2012-01-01

    We report a new method to produce liquid suspensions of nanoparticles by co-deposition with water vapour from the gas-phase in ultra-high vacuum (UHV) conditions. The water is injected from outside the vacuum as a molecular beam onto a substrate maintained at 77 K and forms an ice layer with a UHV vapour pressure. Molecular dynamics simulations confirm that the nanoparticles are soft-landed close to the surface of the growing ice layer. We show that the un-agglomerated size distribution within the liquid is similar to the gas-phase size distribution and demonstrate that the inclusion of surfactants in the injected water prevents agglomeration. The method allows the flexibility and tight size control available with gas-phase production methods to be applied to making nanoparticle suspensions with any desired properties. This is important for practical applications, especially in medicine. We have extended the method to include core–shell nanoparticles, in which there is flexible control over the core size and shell thickness and free choice of the material in either. Here, we report the production of suspensions of Cu, Ag and Au elemental nanoparticles and Fe-Au and Fe-Fe-oxide core–shell nanoparticles with diameters in the range 5–15 nm. We demonstrate the power of the method in practical applications in the case of Fe-Fe-oxide nanoparticles, which have a specific absorption rate of an applied oscillating magnetic field that is significantly higher than available Fe-oxide nanoparticle suspensions and the highest yet reported. These will thus have a very high-performance in the treatment of tumours by magnetic nanoparticle hyperthermia.

  8. Preparation of hydrosol suspensions of elemental and core-shell nanoparticles by co-deposition with water vapour from the gas-phase in ultra-high vacuum conditions

    Energy Technology Data Exchange (ETDEWEB)

    Binns, Chris, E-mail: cb12@leicester.ac.uk [University of Leicester, Department of Physics and Astronomy (United Kingdom); Prieto, Pilar [Universidad Autonoma de Madrid, Departamento de F Latin-Small-Letter-Dotless-I sica Aplicada C-XII (Spain); Baker, Stephen; Howes, Paul [University of Leicester, Department of Physics and Astronomy (United Kingdom); Dondi, Ruggero [University of Leicester, Department of Chemistry (United Kingdom); Burley, Glenn [University of Strathclyde, Department of Pure and Applied Chemistry (United Kingdom); Lari, Leonardo; Kroeger, Roland; Pratt, Andrew [University of York, Department of Physics (United Kingdom); Aktas, Sitki [University of Leicester, Department of Physics and Astronomy (United Kingdom); Mellon, John K. [University of Leicester, Department of Cancer Studies and Molecular Medicine (United Kingdom)

    2012-09-15

    We report a new method to produce liquid suspensions of nanoparticles by co-deposition with water vapour from the gas-phase in ultra-high vacuum (UHV) conditions. The water is injected from outside the vacuum as a molecular beam onto a substrate maintained at 77 K and forms an ice layer with a UHV vapour pressure. Molecular dynamics simulations confirm that the nanoparticles are soft-landed close to the surface of the growing ice layer. We show that the un-agglomerated size distribution within the liquid is similar to the gas-phase size distribution and demonstrate that the inclusion of surfactants in the injected water prevents agglomeration. The method allows the flexibility and tight size control available with gas-phase production methods to be applied to making nanoparticle suspensions with any desired properties. This is important for practical applications, especially in medicine. We have extended the method to include core-shell nanoparticles, in which there is flexible control over the core size and shell thickness and free choice of the material in either. Here, we report the production of suspensions of Cu, Ag and Au elemental nanoparticles and Fe-Au and Fe-Fe-oxide core-shell nanoparticles with diameters in the range 5-15 nm. We demonstrate the power of the method in practical applications in the case of Fe-Fe-oxide nanoparticles, which have a specific absorption rate of an applied oscillating magnetic field that is significantly higher than available Fe-oxide nanoparticle suspensions and the highest yet reported. These will thus have a very high-performance in the treatment of tumours by magnetic nanoparticle hyperthermia.

  9. Vapour pressure and heat capacities of metal organic precursors, Y(thd).sub.3./sub. and Zr(thd).sub.4./sub

    Czech Academy of Sciences Publication Activity Database

    Fulem, Michal; Růžička, K.; Růžička, V.; Šimeček, Tomislav; Hulicius, Eduard; Pangrác, Jiří

    2004-01-01

    Roč. 264, - (2004), s. 192-200 ISSN 0022-0248 R&D Projects: GA AV ČR KSK1010104 Keywords : static method * vapour pressure * metalorganic chemical vapor deposition * Y and Zr precursors * .alpha.-diketonate complexes Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.707, year: 2004

  10. Studies of free-to-bound acceptor photoluminescence in an applied magnetic field for undoped GaAs grown by metalorganic vapor-phase epitaxy and molecular-beam epitaxy

    Science.gov (United States)

    Zemon, S.; Norris, P.; Koteles, E. S.; Lambert, G.

    1986-04-01

    Photoluminescence in an applied magnetic field is shown to be useful for the identification of trace acceptor impurities in GaAs. For an epitaxial layer grown by metalorganic vapor-phase epitaxy (MOVPE), a trace concentration of zinc acceptors was detected in a sample where the zinc transitions were obscured in zero magnetic field. In material grown by molecular-beam epitaxy (MBE), the 1.47-eV transition was identified as a conduction-band-to-deep-acceptor process. Also identified was a shallow impurity, magnesium or beryllium, not detected in zero field. Resolved Landau level transitions and the magnetic splitting of conduction-band-to-acceptor transitions were observed in both MOVPE and MBE material.

  11. Unexpected bismuth concentration profiles in metal-organic vapor phase epitaxy-grown Ga(As1−xBix/GaAs superlattices revealed by Z-contrast scanning transmission electron microscopy imaging

    Directory of Open Access Journals (Sweden)

    A. W. Wood

    2015-03-01

    Full Text Available A set of GaAs1−xBix/GaAs multilayer quantum-well structures was deposited by metal-organic vapor phase epitaxy at 390 °C and 420 °C. The precursor fluxes were introduced with the intent of growing discrete and compositionally uniform GaAs1−xBix well and GaAs barrier layers in the epitaxial films. High-resolution high-angle annular-dark-field (or “Z-contrast” scanning transmission electron microscopy imaging revealed concentration profiles that were periodic in the growth direction, but far more complicated in shape than the intended square wave. The observed composition profiles could explain various reports of physical properties measurements that suggest compositional inhomogeneity in GaAs1−xBix alloys as they currently are grown.

  12. Polyethylene Oxide Films Polymerized by Radio Frequency Plasma-Enhanced Chemical Vapour Phase Deposition and Its Adsorption Behaviour of Platelet-Rich Plasma

    International Nuclear Information System (INIS)

    Wen-Juan, Hu; Fen-Yan, Xie; Qiang, Chen; Jing, Weng

    2008-01-01

    We present polyethylene oxide (PEO) functional films polymerized by rf plasma-enhanced vapour chemical deposition (rf-PECVD) on p-Si (100) surface with precursor ethylene glycol dimethyl ether (EGDME) and diluted Ar in pulsed plasma mode. The influences of discharge parameters on the film properties and compounds are investigated. The film structure is analysed by Fourier transform infrared (FTIR) spectroscopy. The water contact angle measurement and atomic force microscope (AFM) are employed to examine the surface polarity and to detect surface morphology, respectively. It is concluded that the smaller duty cycle in pulsed plasma mode contributes to the rich C-O-C (EO) group on the surfaces. As an application, the adsorption behaviour of platelet-rich plasma on plasma polymerization films performed in-vitro is explored. The shapes of attached cells are studied in detail by an optic invert microscope, which clarifies that high-density C-O-C groups on surfaces are responsible for non-fouling adsorption behaviour of the PEO films

  13. Polyethylene Oxide Films Polymerized by Radio Frequency Plasma-Enhanced Chemical Vapour Phase Deposition and Its Adsorption Behaviour of Platelet-Rich Plasma

    Science.gov (United States)

    Hu, Wen-Juan; Xie, Fen-Yan; Chen, Qiang; Weng, Jing

    2008-10-01

    We present polyethylene oxide (PEO) functional films polymerized by rf plasma-enhanced vapour chemical deposition (rf-PECVD) on p-Si (100) surface with precursor ethylene glycol dimethyl ether (EGDME) and diluted Ar in pulsed plasma mode. The influences of discharge parameters on the film properties and compounds are investigated. The film structure is analysed by Fourier transform infrared (FTIR) spectroscopy. The water contact angle measurement and atomic force microscope (AFM) are employed to examine the surface polarity and to detect surface morphology, respectively. It is concluded that the smaller duty cycle in pulsed plasma mode contributes to the rich C-O-C (EO) group on the surfaces. As an application, the adsorption behaviour of platelet-rich plasma on plasma polymerization films performed in-vitro is explored. The shapes of attached cells are studied in detail by an optic invert microscope, which clarifies that high-density C-O-C groups on surfaces are responsible for non-fouling adsorption behaviour of the PEO films.

  14. Networks of ultra-fine Ag nanocrystals in a Teflon AF (registered) matrix by vapour phase e-beam-assisted deposition

    International Nuclear Information System (INIS)

    Biswas, A; Bayer, I S; Marken, B; Pounds, T D; Norton, M G

    2007-01-01

    We have fabricated nanocomposite thin films comprising silver (Ag) nanoparticles dispersed in a Teflon AF (registered) polymer matrix using electron-beam-assisted physical vapour deposition. Four different Ag nanoparticle volume fillings (20%, 35%, 70% and 75%) were achieved by varying the relative metal-polymer evaporation rates with the formation of highly crystalline Ag nanoparticles regardless of the filling ratio. The present fabrication technique allowed full control over dispersion uniformity of nanoparticles in the polymer network. At 20% and 35% metal volume fillings, the nanocomposite film morphology consists of a uniformly dispersed assembly of equiaxed isolated Ag nanoparticles. At higher metal volume fractions the nanocomposite structures displayed two different and unique Ag nanoparticle arrangements within the polymer matrix. In particular, at 70% metal filling, the formation of irregularly shaped clusters of individually assembled nanocrystals was observed. At a slightly higher volume filling (75%), larger irregularly shaped Ag nanocrystals that appeared to be the result of coalescence and grain growth were observed. Finally, a composite theory developed by Tandon and Weng was used to estimate various elastic properties of the nanocomposite films. At high metal filling, the reinforcing effect of the Ag nanoparticles was reflected as approximately a sixfold increase in the elastic modulus compared to the virgin polymer film. Possible applications of such ultra-fine metal nanoparticles networks are discussed

  15. WALES: water vapour lidar experiment in space

    Science.gov (United States)

    Guerin, F.; Pain, Th.; Palmade, J.-L.; Pailharey, E.; Giraud, D.; Jubineau, F.

    2017-11-01

    The WAter vapour Lidar Experiment in Space (WALES) mission aims at providing water vapour profiles with high accuracy and vertical resolution through the troposphere and the lower stratosphere on a global scale using an instrument based on Differential Absorption Lidar (DIAL) observation technique, and mounted on an Earth orbiting satellite. This active DIAL technique will also provide data on the cloud coverage by means of the signal reflection on the cloud layers. In DIAL operation, backscatter lidar signals at two wavelengths - at least - are detected. One wavelength (λ ON) is highly absorbed by the species of interest, while the other (λ OFF) is backscattered with minimal absorption. This difference in absorption at the two transmitted wavelengths leads to the determination of the concentration of the species of interest. The DIAL is therefore a dual-wavelength lidar in which the signals detected at the two wavelengths are processed to extract the absolute density of water vapour. The Phase A study performed by ALCATEL Space and their partners under contract of the European Space Agency has led to a credible and innovative concept of instrument, based on a mission performance modelling. The challenge is to foster the scientific return while minimising the development risks and costs of instrument development, in particular the laser transmitter. The paper describes the payload design and the implementation on a low Earth orbiting (LEO) satellite.

  16. Thermogravimetric studies of vapour-aerosol interactions

    International Nuclear Information System (INIS)

    Henshaw, J.; Newland, M.S.; Wood, S.J.

    1991-01-01

    Thermogravimetric analysis has been used to study the interaction of iodine vapour with cadmium, silver and manganese monoxide substrates. These studies have demonstrated the importance of time-dependence data on reaction rates. Iodine did not react with manganese monoxide (as expected from thermodynamic considerations); however, extensive reaction did occur with silver and cadmium. Two rate limiting mechanisms were observed: mass transfer of iodine molecules from the gas phase (leading to linear reaction rates) and parabolic kinetics (ie inversely proportional to the extent of reaction) when the rate was limited by a diffusion process through the reaction product. (author)

  17. Metallated metal-organic frameworks

    Energy Technology Data Exchange (ETDEWEB)

    Bury, Wojciech; Farha, Omar K.; Hupp, Joseph T.; Mondloch, Joseph E.

    2017-02-07

    Porous metal-organic frameworks (MOFs) and metallated porous MOFs are provided. Also provided are methods of metallating porous MOFs using atomic layer deposition and methods of using the metallated MOFs as catalysts and in remediation applications.

  18. Metallated metal-organic frameworks

    Energy Technology Data Exchange (ETDEWEB)

    Bury, Wojciech; Farha, Omar K.; Hupp, Joseph T.; Mondloch, Joseph E.

    2017-08-22

    Porous metal-organic frameworks (MOFs) and metallated porous MOFs are provided. Also provided are methods of metallating porous MOFs using atomic layer deposition and methods of using the metallated MOFs as catalysts and in remediation applications.

  19. Mechanical Alloying of Metal-Organic Frameworks.

    Science.gov (United States)

    Panda, Tamas; Horike, Satoshi; Hagi, Keisuke; Ogiwara, Naoki; Kadota, Kentaro; Itakura, Tomoya; Tsujimoto, Masahiko; Kitagawa, Susumu

    2017-02-20

    The solvent-free mechanical milling process for two distinct metal-organic framework (MOF) crystals induced the formation of a solid solution, which is not feasible by conventional solution-based syntheses. X-ray and STEM-EDX studies revealed that performing mechanical milling under an Ar atmosphere promotes the high diffusivity of each metal ion in an amorphous solid matrix; the amorphous state turns into the porous crystalline structure by vapor exposure treatment to form a new phase of a MOF solid solution. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  20. Zirconium-based highly porous metal-organic framework (MOF-545) as an efficient adsorbent for vortex assisted-solid phase extraction of lead from cereal, beverage and water samples.

    Science.gov (United States)

    Tokalıoğlu, Şerife; Yavuz, Emre; Demir, Selçuk; Patat, Şaban

    2017-12-15

    In this study, zirconium-based highly porous metal-organic framework, MOF-545, was synthesized and characterized. The surface area of MOF-545 was found to be 2192m 2 /g. This adsorbent was used for the first time as an adsorbent for the vortex assisted-solid phase extraction of Pb(II) from cereal, beverage and water samples. Lead in solutions was determined by FAAS. The optimal experimental conditions were as follows: the amount of MOF-545, 10mg; pH of sample, 7; adsorption and elution time, 15min; and elution solvent, 2mL of 1molL -1 HCl. Under the optimal conditions of the method, the limit of detection, preconcentration factor and precision as RSD% were found to be 1.78μgL -1 , 125 and 2.6%, respectively. The adsorption capacity of the adsorbent for lead was found to be 73mgg -1 . The method was successfully verified by analyzing two certified reference materials (BCR-482 Lichen and SPS-WW1 Batch 114) and spiked chickpea, bean, wheat, lentil, cherry juice, mineral water, well water and wastewater samples. Copyright © 2017 Elsevier Ltd. All rights reserved.

  1. Preparation of water stable methyl-modified metal-organic framework-5/polyacrylonitrile composite nanofibers via electrospinning and their application for solid-phase extraction of two estrogenic drugs in urine samples.

    Science.gov (United States)

    Asiabi, Mina; Mehdinia, Ali; Jabbari, Ali

    2015-12-24

    The nanofibers of methyl-modified metal-organic framework-5/polyacrylonitrile composite (CH3MOF-5/PAN) were successfully synthesized and used as a solid-phase extraction (SPE) sorbent for pre-concentration of two estrogenic drugs, levonorgestrel and megestrol acetate, in urine samples. A simple, cheap and accessible electrospinning method was employed to prepare a water stable CH3MOF-5/PAN composite. The nanofibers were packed into the mini-disc cartridges to be used as SPE devices. They were also characterized by scanning electron microscopy, thermogravimetric analysis, Fourier transform infrared spectroscopy, X-ray diffraction and N2 adsorption-desorption experiments. The effects of different parameters influencing the extraction efficiency including the type of eluent and its volume, the amount of the sorbent, pH, the ionic strength, the sample volume and the reusability of the sorbent were investigated and optimized. Under the optimized conditions, the linearity varied in range of 0.05-100μgL(-1) with R(2) values higher than 0.999. The limit of detection for both of the analytes was 0.02μgL(-1). The applicability of the method was examined by analyzing the analytes in the urine samples. The recovery of the analytes varied in the range of 82.8-94.8% which shows capability of the method for the determination of the drugs in the urine samples. Copyright © 2015 Elsevier B.V. All rights reserved.

  2. Low frequency vapour phase infrared spectra of metal carbonyls, derivatives of the type xmn (CO)/sub 5/ (where X=Br, Cl, H, D, Ch/sub 3/, Cd/sub 3/ Cf/sub 3/)

    International Nuclear Information System (INIS)

    Mehmood, Z.

    2009-01-01

    Many vibrations which occur in the far-infrared region of spectrum are similar to the types of vibrations found in other regions of the spectrum. They fall in the far-infrared because the atomic masses are large and/or the forces resisting the deformation are small. Most of the vibrations of metal carbonyls fall into this category and hence they give a good example of what can be expected A number of metal carbonyls ego BrMn(CO)/sub 5/, CIMn(CO)/sub 5/, HMn(CO)/sub 5/, DMn(CO)/sub 5/, CH/sub 3/Mn(CO)/sub 5/, CD/sub 3/Mn(CO)/sub 5/ and CF/sub 3/Mn(CO)/sub 5/ have been studied in the vapour phase for first time and it is now possible to discuss the general nature of the vibration in this region. The metal- CO stretching frequencies are found between 350 and 475 cm/sup -1/ The metal-C-O bending frequencies are more scattered and fall between 275 and 650 cm/sup -1/ depending in part upon the phase of motion. The OC-M-CO bending modes occur between 50 and 150 cm/sup -1/. Other vibrations are founds in this region when one or more CO group are replaced by groups in which heavy atoms are attached to the metal. Factor which shifts the positions of the frequencies, such as mass or charge on the metal carbonyl moiety, will be discussed. (author)

  3. Calculation of vapour bubble growth on the lower generatrix of horizontal tubes

    International Nuclear Information System (INIS)

    Chajka, V.D.

    1987-01-01

    The known models of vapour bubble growth are compared with experimental data. Cinematographic study of vapour formation during water boiling was carried out with elements of horizontal tubes of copper 10, 16, 24, 34 and 70 mm in diameter under the pressure of 100 kPa and specific thermal loadings of 20 and 40 kW/m 2 . According to the experimental data the main volume of vapour phase is occupied by vapour bubbles from the lower part of the horizontal tube. Five stages of vapour bubble growth on the lower generatrix of the horizontal tube: nucleation, growth to the point of breaking off from nucleate centre, the breaking off from the nucleate centre, the tube surface flowing around during floating up, the breaking off from the tube surface, were singled out. The shape of vapour volume varied during the whole period of the bubble growth and it was mainly determined by the horizontal tube diameter. The change of vapour bubble radius in time is the function of the horizontal tube diameter. Comparison of the experimental data with the known models of vapour bubble growth has shown, that every stage of vapour bubble growth on the lower generatrix of the tube is determined by the complex of thermal and hydrodynamic conditions, the effect of which depends on the horizontal tube diameter

  4. Vapour Pressure of Diethyl Phthalate

    Czech Academy of Sciences Publication Activity Database

    Roháč, V.; Růžička, K.; Růžička, V.; Zaitsau, D. H.; Kabo, G. J.; Diky, V.; Aim, Karel

    2004-01-01

    Roč. 36, č. 11 (2004), s. 929-937 ISSN 0021-9614 Institutional research plan: CEZ:AV0Z4072921 Keywords : vapour pressure * diethyl phthalate * correlation Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 1.144, year: 2004

  5. An Ising model for metal-organic frameworks

    Science.gov (United States)

    Höft, Nicolas; Horbach, Jürgen; Martín-Mayor, Victor; Seoane, Beatriz

    2017-08-01

    We present a three-dimensional Ising model where lines of equal spins are frozen such that they form an ordered framework structure. The frame spins impose an external field on the rest of the spins (active spins). We demonstrate that this "porous Ising model" can be seen as a minimal model for condensation transitions of gas molecules in metal-organic frameworks. Using Monte Carlo simulation techniques, we compare the phase behavior of a porous Ising model with that of a particle-based model for the condensation of methane (CH4) in the isoreticular metal-organic framework IRMOF-16. For both models, we find a line of first-order phase transitions that end in a critical point. We show that the critical behavior in both cases belongs to the 3D Ising universality class, in contrast to other phase transitions in confinement such as capillary condensation.

  6. Water vapour adsorption on coal

    Czech Academy of Sciences Publication Activity Database

    Švábová, Martina; Weishauptová, Zuzana; Přibyl, Oldřich

    2011-01-01

    Roč. 90, č. 5 (2011), s. 1892-1899 ISSN 0016-2361 R&D Projects: GA ČR GA106/08/1146 Institutional research plan: CEZ:AV0Z30460519 Keywords : water vapour * adsorption * kinetics Subject RIV: DI - Air Pollution ; Quality Impact factor: 3.248, year: 2011 http://www.sciencedirect.com/science/article/pii/S001623611100007X

  7. The Vapour Pressure of Plutonium

    International Nuclear Information System (INIS)

    Mulford, R.N.R.

    1966-01-01

    The vapour pressure of liquid plutonium has been determined over the temperature range 1100 to 1800°K by the Knudsen effusion method. The least-squares equation which fits the data is log 10 p(atm) = -17 420/T(°K) + 4.913. The standard deviation corresponds to about ±10% in the pressures calculated from this equation. The heat of vaporization computed from the temperature dependence of the experimental data is ΔH 0 298 = 82.3 kcal/g-at. The heat computed by combining independent entropy and heat capacity data with the present measurements is ΔH 0 298 = 82.1 kcal/g-at. Effects of oxygen upon the volatility of liquid plutonium were sought by comparing the vapour pressures observed with the liquid in contact with tantalum, tantalum carbide, magnesia, and plutonium sesquioxide. No differences were found. In addition, the vapour pressure was measured with different degrees of vacuum in the system. No effect was found here either, except that in very poor vacuums a surface film of oxide apparently formed and reduced the volatility by about a factor of 2. (author) [fr

  8. Growth and coalescence control of inclined c-axis polar and semipolar GaN multilayer structures grown on Si(111), Si(112), and Si(115) by metalorganic vapor phase epitaxy

    Energy Technology Data Exchange (ETDEWEB)

    Szymański, Tomasz, E-mail: tomasz.szymanski@pwr.edu.pl; Wośko, Mateusz; Paszkiewicz, Bartłomiej; Paszkiewicz, Bogdan; Paszkiewicz, Regina [The Faculty of Microsystem Electronics and Photonics, Wroclaw University of Technology, Janiszewskiego 11/17, 50-372 Wroclaw (Poland); Sankowska, Iwona [The Institute of Electron Technology, Al. Lotnikow 32/46, 02-668 Warszawa (Poland)

    2016-09-15

    Herein, silicon substrates in alternative orientations from the commonly used Si(111) were used to enable the growth of polar and semipolar GaN-based structures by the metalorganic vapor phase epitaxy method. Specifically, Si(112) and Si(115) substrates were used for the epitaxial growth of nitride multilayer structures, while the same layer schemes were also deposited on Si(111) for comparison purposes. Multiple approaches were studied to examine the influence of the seed layers and the growth process conditions upon the final properties of the GaN/Si(11x) templates. Scanning electron microscope images were acquired to examine the topography of the deposited samples. It was observed that the substrate orientation and the process conditions allow control to produce an isolated GaN block growth or a coalesced layer growth, resulting in inclined c-axis GaN structures under various forms. The angles of the GaN c-axis inclination were determined by x-ray diffraction measurements and compared with the results obtained from the analysis of the atomic force microscope (AFM) images. The AFM image analysis method to determine the structure tilt was found to be a viable method to estimate the c-axis inclination angles of the isolated blocks and the not-fully coalesced layers. The quality of the grown samples was characterized by the photoluminescence method conducted at a wide range of temperatures from 77 to 297 K, and was correlated with the sample degree of coalescence. Using the free-excitation peak positions plotted as a function of temperature, analytical Bose-Einstein model parameters were fitted to obtain further information about the grown structures.

  9. A novel metal-organic framework composite MIL-101(Cr)@GO as an efficient sorbent in dispersive micro-solid phase extraction coupling with UHPLC-MS/MS for the determination of sulfonamides in milk samples.

    Science.gov (United States)

    Jia, Xiuna; Zhao, Pan; Ye, Xiu; Zhang, Lianjun; Wang, Ting; Chen, Qinyu; Hou, Xiaohong

    2017-07-01

    As a novel material, metal-organic framework/graphite oxide (MIL-101(Cr)@GO) has great potential for the pretreatment of trace analytes. In the present study, MIL-101(Cr)@GO was synthesized using a solvothermal synthesis method at the nanoscale and was applied as sorbent in the dispersive micro-solid phase extraction (DMSPE) for the enrichment of the trace sulfonamides (SAs) from milk samples for the first time. Several experimental parameters including kinds of sorbents, the effect of pH, the amount of MIL-101(Cr)@GO, ionic strength, adsorption time, desorption solvent and desorption time were investigated. Under the optimal conditions, the linear ranges were from 0.1 to 10μg/L, 0.2-20μg/L or 0.5-50μg/L for the analytes with regression coefficients (r) from 0.9942 to 0.9999. The limits of detection were between 0.012 and 0.145μg/L. The recoveries ranged from 79.83% to 103.8% with relative standard deviations (RSDs)<10% (n=3). MIL-101(Cr)@GO exhibited remarkable advantages compared to MIL-101(Cr), MIL-100(Fe), activated carbon and other sorbent materials used in pretreatment methods. A simple, rapid, sensitive, inexpensive and less solvent consuming method of DMSPE-ultra-high performance liquid chromatography-tandem mass spectrometry (DMSPE-UHPLC-MS/MS) was successfully applied to the pre-concentration and determination of twelve SAs in milk samples. Copyright © 2016 Elsevier B.V. All rights reserved.

  10. Enhanced water vapour flow in silica microchannels and interdiffusive water vapour flow through anodic aluminium oxide (AAO) membranes

    Science.gov (United States)

    Lei, Wenwen; McKenzie, David R.

    2015-12-01

    Enhanced liquid water flows through carbon nanotubes reinvigorated the study of moisture permeation through membranes and micro- and nano-channels. The study of water vapour through micro-and nano-channels has been neglected even though water vapour is as important as liquid water for industry, especially for encapsulation of electronic devices. Here we measure moisture flow rates in silica microchannels and interdiffusive water vapour flows in anodic aluminium oxide (AAO) membrane channels for the first time. We construct theory for the flow rates of the dominant modes of water transport through four previously defined standard configurations and benchmark it against our new measurements. The findings show that measurements of leak behaviour made using other molecules, such as helium, are not reliable. Single phase water vapour flow is overestimated by a helium measurement, while Washburn or capillary flow is underestimated or for all channels when boundary slip applies, to an extent that depends on the slip length for the liquid phase flows.

  11. Evaluation of vadose zone biodegradation of BTX vapours

    Science.gov (United States)

    Hers, Ian; Atwater, Jim; Li, Loretta; Zapf-Gilje, Reidar

    2000-12-01

    Soil vapour transport to indoor air is an important potential exposure pathway at many sites impacted by subsurface volatile organic compounds (VOCs). The inclusion of biodegradation in vadose zone transport models for benzene, toluene and xylene (BTX) and fuel hydrocarbons has been proposed; however, there is still significant uncertainty regarding biodegradation rates and the local effects of buildings or ground surface cover on fate and transport processes. The objective of this study was to evaluate biodegradation processes through comprehensive monitoring at a site contaminated with BTX and model simulation. Study methods included extensive vertical profiling of BTX vapour and light gas (oxygen and carbon dioxide) concentrations and moisture content, and semi-continuous monitoring of oxygen and pressure below a building floor slab. Significant vadose zone biodegradation over a relatively small depth interval was observed. Based on the observed soil vapour profile, first-order biodegradation rates were estimated by fitting an analytical solution for diffusion and biodecay to the data. Degradation rates were found to compare well to other reported laboratory and field data. A two-dimensional (2-D) numerical model incorporating vapour-phase diffusion, advection, sorption and biodegradation was used to simulate the effect of a building floor slab on transport processes. Model results demonstrate the sensitivity of vapour-phase BTX and oxygen transport to partial barriers to diffusion (e.g. building foundation) and highlight the importance of using a model that ties biodecay to oxygen availability. In addition, depressurization within a building and advective transport is shown to have a potentially significant effect on BTX fate, in soil below.

  12. Applications of metal-organic frameworks in heterogeneous supramolecular catalysis.

    Science.gov (United States)

    Liu, Jiewei; Chen, Lianfen; Cui, Hao; Zhang, Jianyong; Zhang, Li; Su, Cheng-Yong

    2014-08-21

    This review summarizes the use of metal-organic frameworks (MOFs) as a versatile supramolecular platform to develop heterogeneous catalysts for a variety of organic reactions, especially for liquid-phase reactions. Following a background introduction about catalytic relevance to various metal-organic materials, crystal engineering of MOFs, characterization and evaluation methods of MOF catalysis, we categorize catalytic MOFs based on the types of active sites, including coordinatively unsaturated metal sites (CUMs), metalloligands, functional organic sites (FOS), as well as metal nanoparticles (MNPs) embedded in the cavities. Throughout the review, we emphasize the incidental or deliberate formation of active sites, the stability, heterogeneity and shape/size selectivity for MOF catalysis. Finally, we briefly introduce their relevance into photo- and biomimetic catalysis, and compare MOFs with other typical porous solids such as zeolites and mesoporous silica with regard to their different attributes, and provide our view on future trends and developments in MOF-based catalysis.

  13. Water vapour pressure within a maize crop

    NARCIS (Netherlands)

    Stigter, C.J.

    1977-01-01

    After review of the purposes that have in the course of time been served by investigations on aerial water vapour pressure inside and just above plant stands, measured vapour pressure profiles within a maize crop are reported and discussed. Special attention is paid to measured horizontal

  14. Intercomparison on measurement of water vapour permeability

    DEFF Research Database (Denmark)

    Hansen, Kurt Kielsgaard

    Three different materials are tested - hard woodfibre board - damp proof course - underlay for roofing The water vapour permeability has been measured according to EN ISO 12572 (2001).......Three different materials are tested - hard woodfibre board - damp proof course - underlay for roofing The water vapour permeability has been measured according to EN ISO 12572 (2001)....

  15. Comparison of Hexane Vapour Permeation Indifferent Membranes.

    OpenAIRE

    Sedláková, Zuzana

    2016-01-01

    The aim of this work was the VOC removal from a polluted air stream. The model mixture contained nitrogen saturated by various concentrations of hexane. The mixture was chosen as a representative binary mixture of the polluted air by gasoline vapours. The nitrogen represented the major component of air and hexane represented the gasoline vapours, respectively.

  16. Insights in the analytical performance of neat metal-organic frameworks in the determination of pollutants of different nature from waters using dispersive miniaturized solid-phase extraction and liquid chromatography.

    Science.gov (United States)

    Rocío-Bautista, Priscilla; Pino, Verónica; Pasán, Jorge; López-Hernández, Irene; Ayala, Juan H; Ruiz-Pérez, Catalina; Afonso, Ana M

    2018-03-01

    Five metal-organic frameworks (MOFs), specifically HKUST-1, MOF-5(Zn), MIL-53(Al), UiO-64 and MOF-74(Zn) are synthesized, characterized, and utilized in a miniaturized solid-phase extraction method under dispersive mode (D-µSPE) for the determination of six pollutants of different nature, including one polycyclic aromatic hydrocarbon, two hormones, two drugs, and one disinfectant, from environmental waters (tap water and wastewater). A discussion of possible interactions justifying the partitioning of target analytes to the MOFs is included, considering not only the analytes' physicochemical characteristics but also those of MOFs: metal nature, structural environment of MOF pores, pore size and pore aperture widths, among others. MIL-53(Al) is selected for its versatility and high extraction efficiency for the target compounds. The D-µSPE method using MIL-53(Al) is optimized and used in combination with high-performance liquid chromatography (HPLC) with diode array detector (DAD) or liquid-chromatography with time-of-flight mass spectrometric detector (LC-TOF). Under optimum conditions, only 5mg of MIL-53(Al) are required for 10mL of water, with the aid of 5min of vortex and 5min of centrifugation. Elution is accomplished with 200µL of acetonitrile (3 times), and evaporation down to 100µL before LC injection. Detection limits down to 0.040μgL -1 for triclosan and 0.013μgL -1 for atrazine are obtained for the entire method using HPLC-DAD and LC-TOF, respectively. The method, operating at low spiked levels (2µgL -1 for HPLC-DAD and 0.7µgL -1 for LC-TOF), is also characterized for average relative recoveries of 109% and 105%; relative standard deviation values lower than 8.7% and 7.5%; and average extraction efficiencies of 41.2% and 49.1%; using HPLC-DAD and LC-TOF, respectively; while demonstrating adequate analytical performance with complex samples such as wastewaters. Copyright © 2017 Elsevier B.V. All rights reserved.

  17. The metal-organic framework HKUST-1 as efficient sorbent in a vortex-assisted dispersive micro solid-phase extraction of parabens from environmental waters, cosmetic creams, and human urine.

    Science.gov (United States)

    Rocío-Bautista, Priscilla; Martínez-Benito, Carla; Pino, Verónica; Pasán, Jorge; Ayala, Juan H; Ruiz-Pérez, Catalina; Afonso, Ana M

    2015-07-01

    Three metal-organic frameworks (MOFs), specifically HKUST-1, MOF-5, and MIL-53(Al), have been synthetized, characterized, studied and compared in a vortex-assisted dispersive micro-solid-phase extraction (VA-D-µ-SPE) procedure in combination with high-performance liquid chromatography (HPLC) with diode-array detection (DAD) for determining seven parabens in environmental waters (tap water, swimming pool water, and water coming from a spa pool), human urine (from two volunteers), and cosmetic creams (two commercial brands). Experimental parameters, such as nature and amount of MOF, sample volume, nature of elution solvent and its amount, vortex and centrifugation time, among others, were properly optimized. HKUST-1 was the most adequate MOF to work with. Detection limits for the overall method down to 0.1 μgL(-1) for butylparaben (BPB) and benzylparaben (BzPB) were obtained, with determination coefficients (R(2)) higher than 0.9966 for a range of 0.5-147 μgL(-1) (depending on the paraben), average relative recoveries (RR, in %) of 80.3% at the low spiked level (7 μgL(-1)), and relative standard deviation (RSD) values below 10% also at the low spiked level. The strength of the affinity between HKUST-1 and parabens was evaluated, and it ranged from 33.5% for isopropylparaben (iPPB) to 77.0% for isobutylparaben (iBPB). When analyzing complex environmental waters, RR values of 78%, inter-day precision values (as RSD) lower than 15%, and intra-day precision values lower than 7.8% were obtained, despite the observed matrix effect. When analyzing cosmetic creams, parabens were detected, with contents ranging from 0.14 ± 0.01 μgg(-1) for EPB in the healing cream analyzed to 1.12 ± 0.07 mgg(-1) for MPB in the mask cream analyzed, with precision values (RSD) lower than 12% and RR values from 63.7% for propylparaben (PPB) to 121% for iPPB. When analyzing human urine, no parabens were detected but the method could be performed with RSD values lower than 19%. These

  18. Nanoselective area growth of GaN by metalorganic vapor phase epitaxy on 4H-SiC using epitaxial graphene as a mask

    Energy Technology Data Exchange (ETDEWEB)

    Puybaret, Renaud; Jordan, Matthew B.; Voss, Paul L.; Ougazzaden, Abdallah, E-mail: aougazza@georgiatech-metz.fr [School of Electrical and Computer Engineering, Georgia Institute of Technology, Atlanta, Georgia 30332 (United States); CNRS UMI 2958, Georgia Institute of Technology, 2 Rue Marconi, 57070 Metz (France); Patriarche, Gilles [CNRS, Laboratoire de Photonique et de Nanostructures, Route de Nozay, 91460 Marcoussis (France); Sundaram, Suresh; El Gmili, Youssef [CNRS UMI 2958, Georgia Institute of Technology, 2 Rue Marconi, 57070 Metz (France); Salvestrini, Jean-Paul [Université de Lorraine, CentraleSupélec, LMOPS, EA4423, 57070 Metz (France); Heer, Walt A. de [School of Physics, Georgia Institute of Technology, Atlanta, Georgia 30332 (United States); Berger, Claire [School of Physics, Georgia Institute of Technology, Atlanta, Georgia 30332 (United States); CNRS, Institut Néel, BP166, 38042 Grenoble Cedex 9 (France)

    2016-03-07

    We report the growth of high-quality triangular GaN nanomesas, 30-nm thick, on the C-face of 4H-SiC using nanoselective area growth (NSAG) with patterned epitaxial graphene grown on SiC as an embedded mask. NSAG alleviates the problems of defects in heteroepitaxy, and the high mobility graphene film could readily provide the back low-dissipative electrode in GaN-based optoelectronic devices. A 5–8 graphene-layer film is first grown on the C-face of 4H-SiC by confinement-controlled sublimation of silicon carbide. Graphene is then patterned and arrays of 75-nm-wide openings are etched in graphene revealing the SiC substrate. A 30-nm-thick GaN is subsequently grown by metal organic vapor phase epitaxy. GaN nanomesas grow epitaxially with perfect selectivity on SiC, in the openings patterned through graphene. The up-or-down orientation of the mesas on SiC, their triangular faceting, and cross-sectional scanning transmission electron microscopy show that they are biphasic. The core is a zinc blende monocrystal surrounded with single-crystal wurtzite. The GaN crystalline nanomesas have no threading dislocations or V-pits. This NSAG process potentially leads to integration of high-quality III-nitrides on the wafer scalable epitaxial graphene/silicon carbide platform.

  19. Evaporation of a volatile organic compound in a hygroscopic soil - influence of the airflow and its VOC vapour saturation

    OpenAIRE

    Naon , Bétaboalé; Benet , Jean-Claude; Cousin , Bruno; Cherblanc , Fabien; Chammari , Ali

    2013-01-01

    International audience; This article presents an experimental and theoretical study of VOC volatilization in soil during a decontamination process by vapour extraction or venting. A phase change law is proposed in the case of a sandy-silty soil when the convective gaseous phase is vapour-charged. A simple experimental method for analyzing the phase change is presented. Finally, an efficiency coefficient is introduced to quantify the contribution of airflow velocity on venting.

  20. Preparation of ionic liquid modified magnetic metal-organic frameworks composites for the solid-phase extraction of α-chymotrypsin.

    Science.gov (United States)

    Wei, Xiaoxiao; Wang, Yuzhi; Chen, Jing; Xu, Panli; Zhou, Yigang

    2018-05-15

    A novel magnetic solid-phase extraction (MSPE) method based on 1-hexyl-3-methyl imidazolium chloride ionic liquid (IL) modified magnetic Fe 3 O 4 nanoparticles, hydroxylated multiwall carbon nanotubes (MWCNTs-OH) and zeolitic imidazolate frameworks (ZIFs) nanocomposites (Fe 3 O 4 -MWCNTs-OH@ZIF-67@IL) were proposed and applied to extract α-chymotrypsin. The magnetic materials were synthesized successfully and characterized by X-ray diffraction (XRD), transmission electron microscope (TEM), thermal gravimetric analysis (TGA), fourier transform infrared spectrometry (FT-IR), vibrating sample magnetometer (VSM) and zeta potentials. Subsequently, the UV-vis spectrophotometer at about 280 nm was utilized to quantitatively analyze the α-chymotrypsin concentration in the supernatant. Furthermore, single factor experiments revealed that the extraction capacity was influenced by initial α-chymotrypsin concentration, ionic strength, extraction time, extraction temperature and pH value. The extraction capacity could reach up to about 635 mg g -1 under the optimized conditions, absolutely higher than that of extraction for Ovalbumin (OVA), Bovine serum albumin (BSA) and Bovine hemoglobin (BHb). In addition, the regeneration studies showed Fe 3 O 4 -MWCNTs-OH@ZIF-67@IL particles could be reused several times and kept a high extraction capacity. Besides, the study of enzymatic activity also indicated that the activity of the extracted α-chymotrypsin was well maintained 93% of initial activity. What's more, the proposed method was successfully applied to extract α-chymotrypsin in porcine pancreas crude extract with satisfactory results. All of above conclusions highlight the great potential of the proposed Fe 3 O 4 -MWCNTs-OH@ZIF-67@IL-MSPE method in the analysis of biomolecules. Copyright © 2018 Elsevier B.V. All rights reserved.

  1. Growth of Self-Catalyzed InP Nanowires by Metalorganic Chemical Vapour Deposition

    International Nuclear Information System (INIS)

    Lv Xiao-Long; Zhang Xia; Yan Xin; Liu Xiao-Long; Cui Jian-Gong; Li Jun-Shuai; Huang Yong-Qing; Ren Xiao-Min

    2012-01-01

    The fabrication of self-catalyzed InP nanowires (NWs) is investigated under different growth conditions. Indium droplets induced by surface reconstruction act as nucleation sites for NW growth. Vertical standing NWs with uniform cross sections are obtained under optimized conditions. It is confirmed that the growth rate of NWs is strongly affected by the surface diffusion adatoms while contributions from the direct impingement of vapor species onto the In droplets can be negligible. The results indicate that the droplet acts as an adatom collector rather than a catalyst. Moreover, the diffusion flow rate of adatoms increases with time at the beginning of growth and stabilizes as the growth proceeds

  2. TOPICAL REVIEW: Some recent developments in the chemical vapour deposition of electroceramic oxides

    Science.gov (United States)

    Jones, Anthony C.; Chalker, Paul R.

    2003-03-01

    Metalorganic chemical vapour deposition (MOCVD) and atomic layer deposition (ALD) are highly promising techniques for the deposition of dielectric and ferroelectric oxide thin films, which have a variety of applications in electronic devices. A key requirement for both MOCVD and ALD is the availability of precursors with appropriate physical properties and decomposition characteristics, but there are problems associated with many of the existing precursors. Therefore, it is sometimes necessary to `tailor' the properties of the precursor in order to optimize MOCVD and ALD process parameters, such as evaporation temperature, deposition temperature, layer purity and uniformity. In this paper, the design of a number of new, improved oxide precursors is described, with emphasis on the influence of molecular structure on precursor properties and on the growth dynamics of the MOCVD and ALD processes.

  3. Autonomous Chemical Vapour Detection by Micro UAV

    Directory of Open Access Journals (Sweden)

    Kent Rosser

    2015-12-01

    Full Text Available The ability to remotely detect and map chemical vapour clouds in open air environments is a topic of significant interest to both defence and civilian communities. In this study, we integrate a prototype miniature colorimetric chemical sensor developed for methyl salicylate (MeS, as a model chemical vapour, into a micro unmanned aerial vehicle (UAV, and perform flights through a raised MeS vapour cloud. Our results show that that the system is capable of detecting MeS vapours at low ppm concentration in real-time flight and rapidly sending this information to users by on-board telemetry. Further, the results also indicate that the sensor is capable of distinguishing “clean” air from “dirty”, multiple times per flight, allowing us to look towards autonomous cloud mapping and source localization applications. Further development will focus on a broader range of integrated sensors, increased autonomy of detection and improved engineering of the system.

  4. Preparation and applications of monolithic structures containing metal-organic frameworks.

    Science.gov (United States)

    Lv, Yongqin; Tan, Xinyi; Svec, Frantisek

    2017-01-01

    Metal-organic frameworks are a new category of advanced porous materials with large surface areas and porosities, uniform pore sizes, tunable surface chemistry, and structural diversity. In combination with monoliths, they allow the fine tuning of desired interactions required in a variety of applications. This review article summarizes results of recent studies focused on synthetic strategies enabling incorporation of metal-organic frameworks in monolithic structures. A diverse array of applications including chromatographic separation, solid-phase microextraction, sample enrichment, heterogeneous catalysis, and enzymatic catalysis are also described. © 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  5. Vapour-liquid equilibrium studies at atmospheric to moderate pressures

    Science.gov (United States)

    Russell, Paul Andrew

    A study of vapour-liquid equilibria is presented together with current developments. The theory of vapour-liquid equilibria is discussed. Both experimental and prediction methods for obtaining vapour-liquid equilibria data are critically reviewed. The development of a new family of equilibrium stills to measure experimental VLE data from sub-atmosphere to 35 bar pressure is described. Existing experimental techniques are reviewed, to highlight the needs for these new apparati and their major attributes. Details are provided of how apparatus may be further improved and how computer control may be implemented. To provide a rigorous test of the apparatus the stills have been commissioned using acetic acid-water mixture at one atmosphere pressure. A Barker-type consistency test computer program, which allows for association in both phases has been applied to the data generated and clearly shows that the stills produce data of a very high quality. Two high quality data sets, for the mixture acetone- chloroform, have been generated at one atmosphere and 64.3oC. These data are used to investigate the ability of the new novel technique, based on molecular parameters, to predict VLE data for highly polar mixtures. Eight vapour-liquid equilibrium data sets have been produced for the mixture cyclohexane-ethanol mixture at one atmosphere, 2, 4, 6, 8 and 11 bar, 90.9oC and 132.8oC. These data sets have been tested for thermodynamic consistency using a Barker-type fitting package and shown to be of high quality. The data have been used to investigate the dependence of UNIQUAC parameters with temperature. The data have in addition been used to compare directly the performance of the predictive methods, Original UNIFAC, a modified version of UNIFAC and the new novel technique, based on molecular parameters developed from generalised London's potential (GLP) theory.

  6. Modelling and optimization of film thickness variation for plasma enhanced chemical vapour deposition processes

    Science.gov (United States)

    Waddell, Ewan; Gibson, Des; Lin, Li; Fu, Xiuhua

    2011-09-01

    This paper describes a method for modelling film thickness variation across the deposition area within plasma enhanced chemical vapour deposition (PECVD) processes. The model enables identification and optimization of film thickness uniformity sensitivities to electrode configuration, temperature, deposition system design and gas flow distribution. PECVD deposition utilizes a co-planar 300mm diameter electrodes with separate RF power matching to each electrode. The system has capability to adjust electrode separation and electrode temperature as parameters to optimize uniformity. Vacuum is achieved using dry pumping with real time control of butterfly valve position for active pressure control. Comparison between theory and experiment is provided for PECVD of diamond-like-carbon (DLC) deposition onto flat and curved substrate geometries. The process utilizes butane reactive feedstock with an argon carrier gas. Radiofrequency plasma is used. Deposited film thickness sensitivities to electrode geometry, plasma power density, pressure and gas flow distribution are demonstrated. Use of modelling to optimise film thickness uniformity is demonstrated. Results show DLC uniformity of 0.30% over a 200 mm flat zone diameter within overall electrode diameter of 300mm. Thickness uniformity of 0.75% is demonstrated over a 200mm diameter for a non-conformal substrate geometry. Use of the modelling method for PECVD using metal-organic chemical vapour deposition (MOCVD) feedstock is demonstrated, specifically for deposition of silica films using metal-organic tetraethoxy-silane. Excellent agreement between experimental and theory is demonstrated for conformal and non-conformal geometries. The model is used to explore scalability of PECVD processes and trade-off against film thickness uniformity. Application to MEMS, optical coatings and thin film photovoltaics is discussed.

  7. Growth and Characterization of (211)B Cadmium Telluride Buffer Layer Grown by Metal-organic Vapor Phase Epitaxy on Nanopatterned Silicon for Mercury Cadmium Telluride Based Infrared Detector Applications

    Science.gov (United States)

    Shintri, Shashidhar S.

    Mercury cadmium telluride (MCT or Hg1-xCdxTe) grown by molecular beam epitaxy (MBE) is presently the material of choice for fabricating infrared (IR) detectors used in night vision based military applications. The focus of MCT epitaxy has gradually shifted since the last decade to using Si as the starting substrate since it offers several advantages. But the ˜19 % lattice mismatch between MCT and Si generates lots of crystal defects some of which degrade the performance of MCT devices. Hence thick CdTe films are used as buffer layers on Si to accommodate the defects. However, growth of high quality single crystal CdTe on Si is challenging and to date, the best MBE CdTe/Si reportedly has defects in the mid-105 cm -2 range. There is a critical need to reduce the defect levels by at least another order of magnitude, which is the main motivation behind the present work. The use of alternate growth technique called metal-organic vapor phase epitaxy (MOVPE) offers some advantages over MBE and in this work MOVPE has been employed to grow the various epitaxial films. In the first part of this work, conditions for obtaining high quality (211)B CdTe epitaxy on (211)Si were achieved, which also involved studying the effect of having additional intermediate buffer layers such as Ge and ZnTe and incorporation of in-situ thermal cyclic annealing (TCA) to reduce the dislocation density. A critical problem of Si cross-contamination due to 'memory effect' of different reactant species was minimized by introducing tertiarybutylArsine (TBAs) which resulted in As-passivation of (211)Si. The best 8-10 µm thick CdTe films on blanket (non-patterned) Si had dislocations around 3×105 cm-2, which are the best reported by MOVPE till date and comparable to the highest quality films available by MBE. In the second part of the work, nanopatterned (211)Si was used to study the effect of patterning on the crystal quality of epitaxial CdTe. In one such study, patterning of ˜20 nm holes in SiO2

  8. The millennium water vapour drop in chemistry–climate model simulations

    Directory of Open Access Journals (Sweden)

    S. Brinkop

    2016-07-01

    Full Text Available This study investigates the abrupt and severe water vapour decline in the stratosphere beginning in the year 2000 (the "millennium water vapour drop" and other similarly strong stratospheric water vapour reductions by means of various simulations with the state-of-the-art Chemistry-Climate Model (CCM EMAC (ECHAM/MESSy Atmospheric Chemistry Model. The model simulations differ with respect to the prescribed sea surface temperatures (SSTs and whether nudging is applied or not. The CCM EMAC is able to most closely reproduce the signature and pattern of the water vapour drop in agreement with those derived from satellite observations if the model is nudged. Model results confirm that this extraordinary water vapour decline is particularly obvious in the tropical lower stratosphere and is related to a large decrease in cold point temperature. The drop signal propagates under dilution to the higher stratosphere and to the poles via the Brewer–Dobson circulation (BDC. We found that the driving forces for this significant decline in water vapour mixing ratios are tropical sea surface temperature (SST changes due to a coincidence with a preceding strong El Niño–Southern Oscillation event (1997/1998 followed by a strong La Niña event (1999/2000 and supported by the change of the westerly to the easterly phase of the equatorial stratospheric quasi-biennial oscillation (QBO in 2000. Correct (observed SSTs are important for triggering the strong decline in water vapour. There are indications that, at least partly, SSTs contribute to the long period of low water vapour values from 2001 to 2006. For this period, the specific dynamical state of the atmosphere (overall atmospheric large-scale wind and temperature distribution is important as well, as it causes the observed persistent low cold point temperatures. These are induced by a period of increased upwelling, which, however, has no corresponding pronounced signature in SSTs anomalies in the tropics

  9. Self-Exfoliated Metal-Organic Nanosheets through Hydrolytic Unfolding of Metal-Organic Polyhedra.

    Science.gov (United States)

    Garai, Bikash; Mallick, Arijit; Das, Anuja; Mukherjee, Rabibrata; Banerjee, Rahul

    2017-05-29

    Few-layers thick metal-organic nanosheets have been synthesized using water-assisted solid-state transformation through a combined top-down and bottom-up approach. The metal-organic polyhedra (MOPs) convert into metal-organic frameworks (MOFs) which subsequently self-exfoliate into few-layered metal-organic nanosheets. These MOP crystals experience a hydrophobicity gradient with the inner surface during contact with water because of the existence of hydrophobic spikes on their outer surface. When the amount of water available for interaction is higher, the resultant layers are not stacked to form bulk materials; instead few-layered nanosheets with high uniformity were obtained in high yield. The phenomenon has resulted high yield production of uniformly distributed layered metal-organic nanosheets from three different MOPs, showing its general adaptability. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  10. An externally heated copper vapour laser

    International Nuclear Information System (INIS)

    Rochefort, P.A.; Sopchyshyn, F.C.; Selkirk, E.B.; Green, L.W.

    1993-08-01

    A pulsed Copper Vapour Laser (CVL), with a nominal 6 kHz repetition rate, was designed, build, and commissioned at Chalk River laboratories. The laser was required for Resonant Ionization Mass Spectroscopy (RIMS) experiments and for projects associated with Atomic Vapour laser Isotope Separation (AVLIS) studies. For the laser to operate, copper coupons position along the length of a ceramic tube must be heated sufficiently to create an appropriate vapour pressure. The AECL CVL uses an external heater element with a unique design to raise the temperature of the tube. The Cylindrical graphite heating element is shaped to compensate for the large radiation end losses of the laser tube. The use of an external heater saves the expensive high-current-voltage switching device from heating the laser tube, as in most commercial lasers. This feature is especially important given the intermittent usage typical of experimental research. As well, the heater enables better parametric control of the laser output when studying the lasing of copper (or other) vapour. This report outlines the lasing process in copper vapour, describes in detail all three major laser sub-systems: the laser body; the laser tube heater; the high voltage pulsed discharge; and, reports parametric measurements of the individual sub-systems and the laser system as a whole. Also included are normal operating procedures to heat up, run and shut down the laser

  11. 3D imaging of vapour and liquid inclusions from the Mole Granite, Australia, using helical fluorescence tomography

    Energy Technology Data Exchange (ETDEWEB)

    Cauzid, J. [European Synchrotron Radiation Facility, 6 rue Jules Horowitz, BP 220, 38043 Grenoble Cedex (France)], E-mail: jean.cauzid@esrf.fr; Philippot, P. [Geobiosphere Actuelle et Primitive, Institut de Physique du Globe de Paris, CNRS and Universite Denis Diderot, Case 89, 4 place Jussieu, 75252 Paris Cedex 05 (France); Bleuet, P. [European Synchrotron Radiation Facility, 6 rue Jules Horowitz, BP 220, 38043 Grenoble Cedex (France); Simionovici, A. [Laboratoire de Geophysique Interne et Tectonophysique, BP 53, 38041 Grenoble Cedex 9 (France); Somogyi, A. [Synchrotron Soleil, DiffAbs beamline, Saint-Aubin, BP 48, 91192 Gif-sur-Yvette Cedex (France); Golosio, B. [Instituto di Matematica e Fisica, Universita di Sassari, 2 via Vienna, 07100 Sassari (Italy)

    2007-08-15

    World class Cu resources are concentrated in porphyry and epithermal ore deposits. Their formation remains partially understood, however, due to a lack of constraints on the partitioning properties of trace elements in general, and Cu in particular, between vapour and liquid phases evolved from boiling fluids at depth in the Earth's crust. Immiscible liquid and vapour fluid inclusions coexisting in a single quartz grain have been imaged in three dimensions by X-ray Fluorescence Computed Tomography (XFCT). Elemental spatial distributions confirm that Cu, and to a lesser extent As, partition into the vapour phase, whereas Mn, Fe, Zn, Br, Rb, Sr and Pb concentrate in the liquid inclusion. High resolution mapping of the vapour inclusions revealed that Cu is heterogeneously distributed at the scale of a single inclusion and is mostly concentrated as tiny daughter crystals.

  12. Improved grand canonical sampling of vapour-liquid transitions.

    Science.gov (United States)

    Wilding, Nigel B

    2016-10-19

    Simulation within the grand canonical ensemble is the method of choice for accurate studies of first order vapour-liquid phase transitions in model fluids. Such simulations typically employ sampling that is biased with respect to the overall number density in order to overcome the free energy barrier associated with mixed phase states. However, at low temperature and for large system size, this approach suffers a drastic slowing down in sampling efficiency. The culprits are geometrically induced transitions (stemming from the periodic boundary conditions) which involve changes in droplet shape from sphere to cylinder and cylinder to slab. Since the overall number density does not discriminate sufficiently between these shapes, it fails as an order parameter for biasing through the transitions. Here we report two approaches to ameliorating these difficulties. The first introduces a droplet shape based order parameter that generates a transition path from vapour to slab states for which spherical and cylindrical droplets are suppressed. The second simply biases with respect to the number density in a tetragonal subvolume of the system. Compared to the standard approach, both methods offer improved sampling, allowing estimates of coexistence parameters and vapor-liquid surface tension for larger system sizes and lower temperatures.

  13. Using Peltier Cells to Study Solid-Liquid-Vapour Transitions and Supercooling

    Science.gov (United States)

    Torzo, Giacomo; Soletta, Isabella; Branca, Mario

    2007-01-01

    We propose an apparatus for teaching experimental thermodynamics in undergraduate introductory courses, using thermoelectric modules and a real-time data acquisition system. The device may be made at low cost, still providing an easy approach to the investigation of liquid-solid and liquid-vapour phase transitions and of metastable states…

  14. Isothermal vapour-liquid equilibria data of methanol + propan-2-OL ...

    African Journals Online (AJOL)

    methylpropan-2-ol binary mixtures are investigated at 333.15k, using gas chromatographic technique. For binary mixtures, the total pressure, the compositions of the components in the vapour phase are obtained from the instrument and these data are ...

  15. Levels of selected carcinogens and toxicants in vapour from electronic cigarettes.

    Science.gov (United States)

    Goniewicz, Maciej Lukasz; Knysak, Jakub; Gawron, Michal; Kosmider, Leon; Sobczak, Andrzej; Kurek, Jolanta; Prokopowicz, Adam; Jablonska-Czapla, Magdalena; Rosik-Dulewska, Czeslawa; Havel, Christopher; Jacob, Peyton; Benowitz, Neal

    2014-03-01

    Electronic cigarettes, also known as e-cigarettes, are devices designed to imitate regular cigarettes and deliver nicotine via inhalation without combusting tobacco. They are purported to deliver nicotine without other toxicants and to be a safer alternative to regular cigarettes. However, little toxicity testing has been performed to evaluate the chemical nature of vapour generated from e-cigarettes. The aim of this study was to screen e-cigarette vapours for content of four groups of potentially toxic and carcinogenic compounds: carbonyls, volatile organic compounds, nitrosamines and heavy metals. Vapours were generated from 12 brands of e-cigarettes and the reference product, the medicinal nicotine inhaler, in controlled conditions using a modified smoking machine. The selected toxic compounds were extracted from vapours into a solid or liquid phase and analysed with chromatographic and spectroscopy methods. We found that the e-cigarette vapours contained some toxic substances. The levels of the toxicants were 9-450 times lower than in cigarette smoke and were, in many cases, comparable with trace amounts found in the reference product. Our findings are consistent with the idea that substituting tobacco cigarettes with e-cigarettes may substantially reduce exposure to selected tobacco-specific toxicants. E-cigarettes as a harm reduction strategy among smokers unwilling to quit, warrants further study. (To view this abstract in Polish and German, please see the supplementary files online.).

  16. A mathematical model of vapour film destabilisation

    International Nuclear Information System (INIS)

    Knowles, J.B.

    1985-04-01

    In a hypothetical reactor accident, destabilisation of an intervening vapour film between the molten fuel and liquid coolant by a weak shock wave (trigger), is considered likely to initiate the molten fuel-coolant interaction. The one-dimensional model presented here is part of a larger programme of fundamental research aimed at improved reactor safety. (U.K.)

  17. Developments in vapour cloud explosion blast modeling

    NARCIS (Netherlands)

    Mercx, W.P.M.; Berg, A.C. van den; Hayhurst, C.J.; Robertson, N.J.; Moran, K.C.

    2000-01-01

    TNT Equivalency methods are widely used for vapour cloud explosion blast modeling. Presently, however, other types of models are available which do not have the fundamental objections TNT Equivalency models have. TNO Multi-Energy method is increasingly accepted as a more reasonable alternative to be

  18. Isothermal (vapour + liquid) equilibrium of (cyclic ethers + chlorohexane) mixtures: Experimental results and SAFT modelling

    International Nuclear Information System (INIS)

    Bandres, I.; Giner, B.; Lopez, M.C.; Artigas, H.; Lafuente, C.

    2008-01-01

    Experimental data for the isothermal (vapour + liquid) equilibrium of mixtures formed by several cyclic ethers (tetrahydrofuran, tetrahydropyran, 1,3-dioxolane, and 1,4-dioxane) and chlorohexane at temperatures of (298.15 and 328.15) K are presented. Experimental results have been discussed in terms of both, molecular characteristics of pure compounds and potential intermolecular interaction between them using thermodynamic information of the mixtures obtained earlier. Furthermore, the influence of the temperature on the (vapour + liquid) equilibrium of these mixtures has been explored and discussed. Transferable parameters of the SAFT-VR approach together with standard combining rules have been used to model the phase equilibrium of the mixtures and a description of the (vapour + liquid) equilibrium of them that is in excellent agreement with the experimental data are provided

  19. Measurement and modeling of high-pressure (vapour + liquid) equilibria of (CO2 + alcohol) binary systems

    International Nuclear Information System (INIS)

    Gutierrez, Jorge E.; Bejarano, Arturo; Fuente, Juan C. de la

    2010-01-01

    An apparatus based on a static-analytic method assembled in this work was utilized to perform high pressure (vapour + liquid) equilibria measurements with uncertainties estimated at 2 + 1-propanol), (CO 2 + 2-methyl-1-propanol), (CO 2 + 3-methyl-1-butanol), and (CO 2 + 1-pentanol) binary systems at temperatures of (313, 323, and 333) K, and at pressure range of (2 to 12) MPa. For all the (CO 2 + alcohol) systems, it was visually monitored to insure that there was no liquid immiscibility at the temperatures and pressures studied. The experimental results were correlated with the Peng-Robinson equation of state using the quadratic mixing rules of van der Waals with two adjustable parameters. The calculated (vapour + liquid) equilibria compositions were found to be in good agreement with the experimental values with deviations for the mol fractions <0.12 and <0.05 for the liquid and vapour phase, respectively.

  20. Minerals with metal-organic framework structures.

    Science.gov (United States)

    Huskić, Igor; Pekov, Igor V; Krivovichev, Sergey V; Friščić, Tomislav

    2016-08-01

    Metal-organic frameworks (MOFs) are an increasingly important family of advanced materials based on open, nanometer-scale metal-organic architectures, whose design and synthesis are based on the directed assembly of carefully designed subunits. We now demonstrate an unexpected link between mineralogy and MOF chemistry by discovering that the rare organic minerals stepanovite and zhemchuzhnikovite exhibit structures found in well-established magnetic and proton-conducting metal oxalate MOFs. Structures of stepanovite and zhemchuzhnikovite, exhibiting almost nanometer-wide and guest-filled apertures and channels, respectively, change the perspective of MOFs as exclusively artificial materials and represent, so far, unique examples of open framework architectures in organic minerals.

  1. Combustion dynamics of low vapour pressure nanofuel droplets

    Science.gov (United States)

    Pandey, Khushboo; Chattopadhyay, Kamanio; Basu, Saptarshi

    2017-07-01

    manifested in two frequency ranges: (i) buoyant flame flickering and (ii) auxiliary frequencies arising from high intensity secondary ejections due to bubble ruptures. Addition of alumina NPs enhances the heat absorption rate and ensures the rapid transfer of fuel parcels (detached daughter droplets) from droplet surface to flame front through secondary ejections. Therefore, average HR shows an increasing trend with particle loading rate (PLR). The perikinetic agglomeration model is used to explain the formation of gelatinous sheath during the last phase of droplet burning. Gelatinous mass formed results in bubble entrapment. SEM images of combustion precipitates show entrapped bubble cavities along with surface and sub-surface blowholes. Morphology of combustion precipitate shows a strong variation with PLRs. We have established the coupling mechanisms among heat release, shape oscillations, and secondary atomizations that underline the combustion behaviour of such low vapour pressure nanofuels.

  2. Transient compounds of high alkaline earth metals with custom-made organic ligands as potential precursors for the gas phase separator of high temperature ceramic superconductors

    International Nuclear Information System (INIS)

    Teske, M.

    1993-01-01

    The aim of this work was the representation of new transient custom-made metal/organic compounds of the high alkaline earth metals Ca, Sr and Ba as potential precursors for the gas phase separation (chemical vapour deposition, CVD) of high temperature ceramic superconductors. There is a report on the synthesis and comprehensive characterisation of representatives of the class of compounds of substituted metallocenes and the B diketone compounds of these metals. Some selected compounds were examined as regards their suitability for CVD. The main task was the examination of the effect of structural and electronic parameters of ligands on the properties of the compounds, where the volatility was to the fore. (orig./MM) [de

  3. Magnetic behaviour in metal-organic frameworks

    Indian Academy of Sciences (India)

    The article describes the synthesis, structure and magnetic investigations of a series of metal-organic framework compounds formed with Mn+2 and Ni+2 ions. The structures, determined using the single crystal X-ray diffraction, indicated that the structures possess two- and three-dimensional structures with magnetically ...

  4. Thin films by metal-organic precursor plasma spray

    International Nuclear Information System (INIS)

    Schulz, Douglas L.; Sailer, Robert A.; Payne, Scott; Leach, James; Molz, Ronald J.

    2009-01-01

    While most plasma spray routes to coatings utilize solids as the precursor feedstock, metal-organic precursor plasma spray (MOPPS) is an area that the authors have investigated recently as a novel route to thin film materials. Very thin films are possible via MOPPS and the technology offers the possibility of forming graded structures by metering the liquid feed. The current work employs metal-organic compounds that are liquids at standard temperature-pressure conditions. In addition, these complexes contain chemical functionality that allows straightforward thermolytic transformation to targeted phases of interest. Toward that end, aluminum 3,5-heptanedionate (Al(hd) 3 ), triethylsilane (HSi(C 2 H 5 ) 3 or HSiEt 3 ), and titanium tetrakisdiethylamide (Ti(N(C 2 H 5 ) 2 ) 4 or Ti(NEt 2 ) 4 ) were employed as precursors to aluminum oxide, silicon carbide, and titanium nitride, respectively. In all instances, the liquids contain metal-heteroatom bonds envisioned to provide atomic concentrations of the appropriate reagents at the film growth surface, thus promoting phase formation (e.g., Si-C bond in triethylsilane, Ti-N bond in titanium amide, etc.). Films were deposited using a Sulzer Metco TriplexPro-200 plasma spray system under various experimental conditions using design of experiment principles. Film compositions were analyzed by glazing incidence x-ray diffraction and elemental determination by x-ray spectroscopy. MOPPS films from HSiEt 3 showed the formation of SiC phase but Al(hd) 3 -derived films were amorphous. The Ti(NEt 2 ) 4 precursor gave MOPPS films that appear to consist of nanosized splats of TiOCN with spheres of TiO 2 anatase. While all films in this study suffered from poor adhesion, it is anticipated that the use of heated substrates will aid in the formation of dense, adherent films.

  5. Interactions of fission product vapours with aerosols

    Energy Technology Data Exchange (ETDEWEB)

    Benson, C.G.; Newland, M.S. [AEA Technology, Winfrith (United Kingdom)

    1996-12-01

    Reactions between structural and reactor materials aerosols and fission product vapours released during a severe accident in a light water reactor (LWR) will influence the magnitude of the radiological source term ultimately released to the environment. The interaction of cadmium aerosol with iodine vapour at different temperatures has been examined in a programme of experiments designed to characterise the kinetics of the system. Laser induced fluorescence (LIF) is a technique that is particularly amenable to the study of systems involving elemental iodine because of the high intensity of the fluorescence lines. Therefore this technique was used in the experiments to measure the decrease in the concentration of iodine vapour as the reaction with cadmium proceeded. Experiments were conducted over the range of temperatures (20-350{sup o}C), using calibrated iodine vapour and cadmium aerosol generators that gave well-quantified sources. The LIF results provided information on the kinetics of the process, whilst examination of filter samples gave data on the composition and morphology of the aerosol particles that were formed. The results showed that the reaction of cadmium with iodine was relatively fast, giving reaction half-lives of approximately 0.3 s. This suggests that the assumption used by primary circuit codes such as VICTORIA that reaction rates are mass-transfer limited, is justified for the cadmium-iodine reaction. The reaction was first order with respect to both cadmium and iodine, and was assigned as pseudo second order overall. However, there appeared to be a dependence of aerosol surface area on the overall rate constant, making the precise order of the reaction difficult to assign. The relatively high volatility of the cadmium iodide formed in the reaction played an important role in determining the composition of the particles. (author) 23 figs., 7 tabs., 22 refs.

  6. Bibliography on vapour pressure isotope effects

    International Nuclear Information System (INIS)

    Illy, H.; Jancso, G.

    1976-03-01

    The bibliography of research on vapour pressure isotope effects from 1919 to December 1975 is presented in chronological order. Within each year the references are listed alphabetically according to the name of the first author of each work. The bibliography is followed by a Compound Index containing the names o compounds, but the type of isotopic substituation is not shown. The Author Index includes all authors of the papers. (Sz.N.Z.)

  7. Consistent vapour-liquid equilibrium data containing lipids

    DEFF Research Database (Denmark)

    Cunico, Larissa; Ceriani, Roberta; Sarup, Bent

    for their mixtures in open literature, what makes necessary the development of reliable predictive models based on limited data. To contribute to the missing data, measurements of isobaric vapour-liquid equilibrium (VLE) data of three binary mixtures at two different pressures were performed at State University......) of the VLE data are considered by comparing these values with their pure compound vapor pressures. Van Ness test where also considered in this work (Qtest,1 of program TDE developed at NIST), that check how the measured data represent the thermodynamic models. Boiling temperatures and vapor phase......Consistent physical and thermodynamic properties of pure components and their mixtures are important for process design, simulation, and optimization as well as design of chemical based products. In the case of lipids, it was observed a lack of experimental data for pure compounds and also...

  8. [Qualitative Determination of Organic Vapour Using Violet and Visible Spectrum].

    Science.gov (United States)

    Jiang, Bo; Hu, Wen-zhong; Liu, Chang-jian; Zheng, Wei; Qi, Xiao-hui; Jiang, Ai-li; Wang, Yan-ying

    2015-12-01

    Vapours of organic matters were determined qualitatively employed with ultraviolet-visible absorption spectroscopy. Vapours of organic matters were detected using ultraviolet-visible spectrophotometer employing polyethylene film as medium, the ultraviolet and visible absorption spectra of vegetable oil vapours of soybean oil, sunflower seed oil, peanut oil, rapeseed oil, sesame oil, cotton seed oil, tung tree seed oil, and organic compound vapours of acetone, ethyl acetate, 95% ethanol, glacial acetic acid were obtained. Experimental results showed that spectra of the vegetable oil vapour and the organic compound vapour could be obtained commendably, since ultra violet and visible spectrum of polyethylene film could be deducted by spectrograph zero setting. Different kinds of vegetable oils could been distinguished commendably in the spectra since the λ(max), λ(min), number of absorption peak, position, inflection point in the ultra violet and visible spectra obtained from the vapours of the vegetable oils were all inconsistent, and the vapours of organic compounds were also determined perfectly. The method had a good reproducibility, the ultraviolet and visible absorption spectra of the vapours of sunflower seed oil in 10 times determination were absolutely the same. The experimental result indicated that polyethylene film as a kind of medium could be used for qualitative analysis of ultraviolet and visible absorption spectroscopy. The method for determination of the vapours of the vegetable oils and organic compounds had the peculiarities of fast speed analysis, well reproducibility, accuracy and reliability and low cost, and so on. Ultraviolet and visible absorption spectrum of organic vapour could provide feature information of material vapour and structural information of organic compound, and provide a novel test method for identifying vapour of compound and organic matter.

  9. Heat transfer in vapour-liquid flow of carbon dioxide

    International Nuclear Information System (INIS)

    Yagov, V.V.

    2009-01-01

    During the last decade a number of studies of boiling heat transfer in carbon dioxide notably increase. As a field of CO 2 practical using corresponds to high reduced pressures, and a majority of available experimental data on CO 2 flow boiling even in submillimetric channels relate to turbulent liquid flow regimes, a possibility arises to develop sufficiently general method for HTC predicting. Under the above conditions nucleate boiling occurs up to rather high flow quality, even in annular flow regime due to extremely small size of an equilibrium vapour bubble. This conclusion is in agreement with the available experimental data. The predicting equation for nucleate boiling heat transfer developed by the present author in 1988 is valid for any nonmetallic liquid. A contribution of forced convection in heat transfer is calculated according to the Petukhov et al. equation with correction factor, which accounted for an effect of velocity increase due to evaporation. This effect can be essential at relatively small heat fluxes and rather high mass flow rates. The Reynolds analogy and homogeneous model are used in order to account for the convective heat transfer augmentation in two-phase flow. Due to low ratio of liquid and vapour densities at high reduced pressures the homogeneous approximation of two-phase flow seems to be warranted. A total heat transfer coefficient is calculated as an interpolated value of boiling and convective HTCs. The experimental data on CO 2 flow boiling related to regimes before heated wall dryout incipience are in rather good agreement with the calculations. (author)

  10. Modelling and interpreting the isotopic composition of water vapour in convective updrafts

    Directory of Open Access Journals (Sweden)

    M. Bolot

    2013-08-01

    Full Text Available The isotopic compositions of water vapour and its condensates have long been used as tracers of the global hydrological cycle, but may also be useful for understanding processes within individual convective clouds. We review here the representation of processes that alter water isotopic compositions during processing of air in convective updrafts and present a unified model for water vapour isotopic evolution within undiluted deep convective cores, with a special focus on the out-of-equilibrium conditions of mixed-phase zones where metastable liquid water and ice coexist. We use our model to show that a combination of water isotopologue measurements can constrain critical convective parameters, including degree of supersaturation, supercooled water content and glaciation temperature. Important isotopic processes in updrafts include kinetic effects that are a consequence of diffusive growth or decay of cloud particles within a supersaturated or subsaturated environment; isotopic re-equilibration between vapour and supercooled droplets, which buffers isotopic distillation; and differing mechanisms of glaciation (droplet freezing vs. the Wegener–Bergeron–Findeisen process. As all of these processes are related to updraft strength, particle size distribution and the retention of supercooled water, isotopic measurements can serve as a probe of in-cloud conditions of importance to convective processes. We study the sensitivity of the profile of water vapour isotopic composition to differing model assumptions and show how measurements of isotopic composition at cloud base and cloud top alone may be sufficient to retrieve key cloud parameters.

  11. Modelling of vapour explosion in stratified geometrie

    International Nuclear Information System (INIS)

    Picchi, St.

    1999-01-01

    When a hot liquid comes into contact with a colder volatile liquid, one can obtain in some conditions an explosive vaporization, told vapour explosion, whose consequences can be important on neighbouring structures. This explosion needs the intimate mixing and the fine fragmentation between the two liquids. In a stratified vapour explosion, these two liquids are initially superposed and separated by a vapor film. A triggering of the explosion can induce a propagation of this along the film. A study of experimental results and existent models has allowed to retain the following main points: - the explosion propagation is due to a pressure wave propagating through the medium; - the mixing is due to the development of Kelvin-Helmholtz instabilities induced by the shear velocity between the two liquids behind the pressure wave. The presence of the vapour in the volatile liquid explains experimental propagation velocity and the velocity difference between the two fluids at the pressure wave crossing. A first model has been proposed by Brayer in 1994 in order to describe the fragmentation and the mixing of the two fluids. Results of the author do not show explosion propagation. We have therefore built a new mixing-fragmentation model based on the atomization phenomenon that develops itself during the pressure wave crossing. We have also taken into account the transient aspect of the heat transfer between fuel drops and the volatile liquid, and elaborated a model of transient heat transfer. These two models have been introduced in a multi-components, thermal, hydraulic code, MC3D. Results of calculation show a qualitative and quantitative agreement with experimental results and confirm basic options of the model. (author)

  12. Water vapour measurements during POLINAT 1

    Energy Technology Data Exchange (ETDEWEB)

    Ovarlez, J.; Ovarlez, H. [Centre National de la Recherche Scientifique, 91 - Palaiseau (France). Lab. de Meteorologie Dynamique

    1997-12-31

    The POLINAT (POLlution from aircraft emissions In the North ATlantic flight corridor)1 experiment has been performed within the framework of the Environment Programme of the Commission of the European Community. It was devoted to the study of the pollution from aircraft in the North Atlantic flight corridor, in order to investigate the impact of pollutants emitted by aircraft on the concentrations of ozone and other trace gases in the upper troposphere and lower stratosphere. For that experiment the water vapour content was measured with a frost-point hygrometer on board of the DLR Falcon research aircraft. This instrument is described, and some selected results are given. (author) 19 refs.

  13. Vapour-liquid equilibria of two-centre Lennard-Jones fluids from the NpT plus test particle method

    Science.gov (United States)

    Kriebel, Christian; Müller, Andreas; Winkelmann, Jochen; Fischer, Johann

    Vapour-liquid phase equilibria (VLE) are determined from the NpT plus test particle method for two-centre Lennard-Jones fluids of elongations L* = 0·22, 0·3292, 0·505, and 0·67. The resulting vapour pressures as well as the saturated vapour and liquid densities are correlated by simple equations. The thermodynamic consistency of the VLE data is confirmed on the basis of the Clausius-Clapeyron equation. Comparison is made with results from previous simulations, and from perturbation theory.

  14. Technical committee meeting on aerosol formation, vapour deposits and sodium vapour trapping. Summary report

    International Nuclear Information System (INIS)

    1977-01-01

    The papers presented at the LMFBR meeting on aerosol formation covered the following four main topics: theoretical studies on aerosol behaviour and comparison with experimental results; techniques for measurement of aerosols; techniques for trapping sodium vapour and aerosols in gas circuits; design of components having to cope with aerosol deposits. The resulting summaries, conclusions and recommendations which were were agreed upon are presented

  15. A conservative vapour intrusion screening model of oxygen-limited hydrocarbon vapour biodegradation accounting for building footprint size.

    Science.gov (United States)

    Knight, John H; Davis, Gregory B

    2013-12-01

    Petroleum hydrocarbon vapours pose a reduced risk to indoor air due to biodegradation processes where oxygen is available in the subsurface or below built structures. However, no previous assessment has been available to show the effects of a building footprint (slab size) on oxygen-limited hydrocarbon vapour biodegradation and the potential for oxygen to be present beneath the entire sub-slab region of a building. Here we provide a new, conservative and conceptually simple vapour screening model which links oxygen and hydrocarbon vapour transport and biodegradation in the vicinity and beneath an impervious slab. This defines when vapour risk is insignificant, or conversely when there is potential for vapour to contact the sub-slab of a building. The solution involves complex mathematics to determine the position of an unknown boundary interface between oxygen diffusing in from the ground surface and vapours diffusing upwards from a subsurface vapour source, but the mathematics reduces to a simple relationship between the vapour source concentration and the ratio of the half slab width and depth to the vapour source. Data from known field investigations are shown to be consistent with the model predictions. Examples of 'acceptable' slab sizes for vapour source depths and strengths are given. The predictions are conservative as an estimator of when petroleum hydrocarbon vapours might come in contact with a slab-on-ground building since additional sources of oxygen due to advective flow or diffusion through the slab are ignored. As such the model can be used for screening sites for further investigation. © 2013.

  16. Physical properties of chemical vapour deposited nanostructured carbon thin films

    International Nuclear Information System (INIS)

    Mahadik, D.B.; Shinde, S.S.; Bhosale, C.H.; Rajpure, K.Y.

    2011-01-01

    Research highlights: In the present paper, nanostructured carbon films are grown using a natural precursor 'turpentine oil (C 10 H 16 )' as a carbon source in the simple thermal chemical vapour deposition method. The influence of substrate surface topography (viz. stainless steel, fluorine doped tin oxide coated quartz) and temperature on the evolution of carbon allotropes surfaces topography/microstructural and structural properties are investigated and discussed. - Abstract: A simple thermal chemical vapour deposition technique is employed for the deposition of carbon films by pyrolysing the natural precursor 'turpentine oil' on to the stainless steel (SS) and FTO coated quartz substrates at higher temperatures (700-1100 deg. C). In this work, we have studied the influence of substrate and deposition temperature on the evolution of structural and morphological properties of nanostructured carbon films. The films were characterized by using X-ray diffraction (XRD), scanning electron microscopy (SEM), contact angle measurements, Fourier transform infrared (FTIR) and Raman spectroscopy techniques. XRD study reveals that the films are polycrystalline exhibiting hexagonal and face-centered cubic structures on SS and FTO coated glass substrates respectively. SEM images show the porous and agglomerated surface of the films. Deposited carbon films show the hydrophobic nature. FTIR study displays C-H and O-H stretching vibration modes in the films. Raman analysis shows that, high ID/IG for FTO substrate confirms the dominance of sp 3 bonds with diamond phase and less for SS shows graphitization effect with dominant sp 2 bonds. It reveals the difference in local microstructure of carbon deposits leading to variation in contact angle and hardness, which is ascribed to difference in the packing density of carbon films, as observed also by Raman.

  17. Thin films of metal-organic compounds and metal nanoparticle

    Indian Academy of Sciences (India)

    Thin films of metal-organic compounds and metal nanoparticle-embedded polymers for nonlinear optical applications. S Philip Anthony Shatabdi Porel D ... Thin films based on two very different metal-organic systems are developed and some nonlinear optical applications are explored. A family of zinc complexes which ...

  18. Accelerated growth of oxide film on aluminium alloys under steam: Part I: Effects of alloy chemistry and steam vapour pressure on microstructure

    DEFF Research Database (Denmark)

    Din, Rameez Ud; Gudla, Visweswara C.; Jellesen, Morten S.

    2015-01-01

    of the oxide layeras well as the compactness increased with steam vapour pressure. The increase in vapour pressure also resulted in a better coverage over the intermetallic particles. Oxide layer showed a layered structure with more compact layer at the Al interface and a nano-scale needle like structure...... of alkaline etching pre-treatment influenced the thickness and growth of theoxide. Moreover the steam treatment resulted in the partial oxidation of second phase intermetallic particles present in the aluminium alloy microstructure....

  19. Condensation of water vapour on moss-dominated biological soil ...

    Indian Academy of Sciences (India)

    mean temperature was negatively linearly related to amounts of water vapour condensation for both soil surfaces. The amount of water vapour condensation on BSC and dune sand can be described by the difference between air temperature and dew point with an exponential function, indicating that when the difference of ...

  20. Beam-profile monitor using a sodium-vapour

    CERN Multimedia

    1972-01-01

    Beam-profile monitor using a sodium-vapour curtain at 45 degrees to the ISR beam in Ring I (sodium generator is in white cylinder just left of centre). Electrons produced by ionization of the sodium vapour give an image of the beam on a fluorescent screen that is observed by a TV camera (at upper right).

  1. Morphology of carbon nanotubes prepared via chemical vapour ...

    Indian Academy of Sciences (India)

    phology of the multi-walled carbon nanotubes prepared by chemical vapour deposition of acetylene. The effects of various ... Small angle neutron scattering; carbon nanotube; chemical vapour deposi- tion. PACS Nos 61.05.fg; ... SAXS data were measured using the rotating anode (Rigaku)-based SAXS instrument, BARC ...

  2. The study and the realization of radiation detectors made from polycrystalline diamond films grown by microwave plasma enhanced chemical vapour deposition technique; Etude et realisation de detecteurs de rayonnements a base de films de diamant polycristallin elabores par depot chimique en phase vapeur assiste par plasma micro-onde

    Energy Technology Data Exchange (ETDEWEB)

    Jany, Ch

    1998-10-29

    The aim of this work was to develop radiation detectors made from polycrystalline diamond films grown by microwave plasma enhanced chemical vapour deposition technique. The influence of surface treatments, contact technology and diamond growth parameters on the diamond detectors characteristics was investigated in order to optimise the detector response to alpha particles. The first part of the study focused on the electrical behaviour of as-deposited diamond surface, showing a p type conduction and its influence on the leakage current of the device. A surface preparation process was established in order to reduce the leakage current of the device by surface dehydrogenation using an oxidising step. Several methods to form and treat electrical contacts were also investigated showing that the collection efficiency of the device decreases after contact annealing. In the second part, we reported the influence of the diamond deposition parameters on the characteristics of the detectors. The increase of the deposition temperature and/or methane concentration was shown to lead {eta} to decrease. In contrast, {eta} was found to increase with the micro-wave power. The evolution of the diamond detector characteristics results from the variation in sp{sup 2} phases incorporation and in the crystallography quality of the films. These defects increase the leakage current and reduce the carrier mobility and lifetime. Measurements carried out on detectors with different thicknesses showed that the physical properties varies along the growth direction, improving with the film thickness. Finally, the addition of nitrogen (> 10 ppm) in the gas mixture during diamond deposition was found to strongly reduce the collection efficiency of the detectors. To conclude the study, we fabricated and characterised diamond devices which were used for thermal neutron detection and for the intensity and shape measurement of VUV and soft X-ray pulses. (author)

  3. Non-equilibrium surface tension of the vapour-liquid interface of active Lennard-Jones particles

    NARCIS (Netherlands)

    Paliwal, Siddharth; Prymidis, Vasileios; Filion, Laura; Dijkstra, Marjolein

    2017-01-01

    We study a three-dimensional system of self-propelled Brownian particles interacting via the Lennard-Jones potential. Using Brownian dynamics simulations in an elongated simulation box, we investigate the steady states of vapour-liquid phase coexistence of active Lennard-Jones particles with planar

  4. (Vapour + liquid) equilibria and excess molar enthalpies for binary mixtures containing N,N-dialkylamides and 1-chloroalkanes

    International Nuclear Information System (INIS)

    Garcia-Gimenez, P.; Munoz Embid, J.; Velasco, I.; Otin, S.

    2007-01-01

    Isothermal (vapour + liquid) equilibria (VLE) and excess molar enthalpies H m E have been measured for liquid (N,N-dimethylformamide or N,N-dimethylacetamide + 1-chlorobutane, or + 1-chlorohexane, or + 1-chlorooctane mixtures). The VLE data have been reduced using the Redlich-Kister equation taking into consideration the vapour phase imperfection in terms of 2nd molar virial coefficients. The experimental results show that both H m E andG m E are positive and increase with increasing chain length of the 1-chloroalkane

  5. Influence of special attributes of zeotropic refrigerant mixtures on design and operation of vapour compression refrigeration and heat pump systems

    International Nuclear Information System (INIS)

    Rajapaksha, Leelananda

    2007-01-01

    The use of zeotropic refrigerant mixtures introduces a number of novel issues that affect the established design and operational practices of vapour compression systems used in refrigeration, air conditioning and heat pump applications. Two attributes; composition shift and temperature glide, associated with the phase changing process of zeotropic mixtures are the primary phenomena that bring in these issues. However, relevant researches are uncovering ways how careful system designs and selection of operational parameters allow improving the energy efficiency and the capacity of vapour compression refrigeration systems. Most of these concepts exploit the presence of composition shift and temperature glide. This paper qualitatively discusses how the mixture attributes influence the established heat exchanger design practices, performance and operation of conventional vapour compression systems. How the temperature glide and composition shift can be incorporated to improve the system performance and the efficiency are also discussed

  6. Chemical vapour transport of pyrite (FeS 2) with halogen (Cl, Br, I)

    Science.gov (United States)

    Fiechter, S.; Mai, J.; Ennaoui, A.; Szacki, W.

    1986-12-01

    A systematic study of chemical vapour transport (CVT) of pyrite with halogen, hydrogen halides and ammonium halides as transporting agents has shown that the transport with chlorine and bromine in a temperature gradient Δ T = 920-820 K yields the highest transport rates (˜6 mg/h) with crystals up to 5 mm edge length. Computing thermochemical equilibria and flux functions in the system Fe-S-Hal (Hal = Cl, Br, I) it has been confirmed that the transport velocity of pyrite is limited by the concentration of FeHal 2 in the vapour phase, the equilibrium position between FeHal 2(g) and FeHal 3(g) and the flux directions of the iron gas species.

  7. Biomimicry in metal-organic materials

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, MW; Gu, ZY; Bosch, M; Perry, Z; Zhou, HC

    2015-06-15

    Nature has evolved a great number of biological molecules which serve as excellent constructional or functional units for metal-organic materials (MOMs). Even though the study of biomimetic MOMs is still at its embryonic stage, considerable progress has been made in the past few years. In this critical review, we will highlight the recent advances in the design, development and application of biomimetic MOMs, and illustrate how the incorporation of biological components into MOMs could further enrich their structural and functional diversity. More importantly, this review will provide a systematic overview of different methods for rational design of MOMs with biomimetic features. Published by Elsevier B.V.

  8. Metal-organic frameworks in chromatography.

    Science.gov (United States)

    Yusuf, Kareem; Aqel, Ahmad; ALOthman, Zeid

    2014-06-27

    Metal-organic frameworks (MOFs) emerged approximately two decades ago and are the youngest class of porous materials. Despite their short existence, MOFs are finding applications in a variety of fields because of their outstanding chemical and physical properties. This review article focuses on the applications of MOFs in chromatography, including high-performance liquid chromatography (HPLC), gas chromatography (GC), and other chromatographic techniques. The use of MOFs in chromatography has already had a significant impact; however, the utilisation of MOFs in chromatography is still less common than other applications, and the number of MOF materials explored in chromatography applications is limited. Copyright © 2014 Elsevier B.V. All rights reserved.

  9. Vapour phase synthesis of salol over solid acids via transesterification

    Indian Academy of Sciences (India)

    Administrator

    salicylic acid in phenol is very low, this method requires the use of the latter in higher molar ratios. Hence, the method of transesterification of methyl salicylate with phenol is employed wherein the reac- tants, being mutually soluble in one another, can be mixed in different molar ratios. Also, the solid acid catalysts that have ...

  10. Vapour phase synthesis of salol over solid acids via transesterification

    Indian Academy of Sciences (India)

    Administrator

    an infusion pump before passing over the catalyst. The reaction mixture was fed into the reactor using a flow-rate controller. The liquid products were col- lected at the bottom of the reactor at time intervals of 15 min. Each reaction was carried out for 1 h. Further studies on the effect of mole-ratio of the reactants, catalyst bed ...

  11. Vapour phase synthesis of salol over solid acids via transesterification

    Indian Academy of Sciences (India)

    The catalytic materials were prepared and characterized for their total surface acidity, BET surface area and powder XRD patterns. The effect of mole-ratio of the reactants, catalyst bed temperature, catalyst weight, flowrate of reactants, WHSV and time-on-stream on the conversion (%) of phenol and selectivity (%) of salol ...

  12. Medical cannabis use in Canada: vapourization and modes of delivery

    Directory of Open Access Journals (Sweden)

    Samantha Shiplo

    2016-10-01

    Full Text Available Abstract Background The mode of medical cannabis delivery—whether cannabis is smoked, vapourized, or consumed orally—may have important implications for its therapeutic efficacy and health risks. However, there is very little evidence on current patterns of use among Canadian medical cannabis users, particularly with respect to modes of delivery. The current study examined modes of medical cannabis delivery following regulatory changes in 2014 governing how Canadians access medical cannabis. Methods A total of 364 approved adult Canadian medical cannabis users completed an online cross-sectional survey between April and June 2015. The survey examined patterns of medical cannabis use, modes of delivery used, and reasons for use. Participants were recruited through a convenience sample from nine Health Canada licensed producers. Results Using a vapourizer was the most popular mode of delivery for medical cannabis (53 %, followed by smoking a joint (47 %. The main reason for using a vapourizer was to reduce negative health consequences associated with smoking. A majority of current vapourizer users reported using a portable vapourizer (67.2 %, followed by a stationary vapourizer (41.7 %, and an e-cigarette or vape pen (19.3 %. Current use of a vapourizer was associated with fewer respiratory symptoms (AOR = 1.28, 95 % CI 1.05–1.56, p = 0.01. Conclusions The findings suggest an increase in the popularity of vapourizers as the primary mode of delivery among approved medical users. Using vapourizers has the potential to prevent some of the adverse respiratory health consequences associated with smoking and may serve as an effective harm reduction method. Monitoring implications of such current and future changes to medical cannabis regulations may be beneficial to policymakers.

  13. Medical cannabis use in Canada: vapourization and modes of delivery.

    Science.gov (United States)

    Shiplo, Samantha; Asbridge, Mark; Leatherdale, Scott T; Hammond, David

    2016-10-29

    The mode of medical cannabis delivery-whether cannabis is smoked, vapourized, or consumed orally-may have important implications for its therapeutic efficacy and health risks. However, there is very little evidence on current patterns of use among Canadian medical cannabis users, particularly with respect to modes of delivery. The current study examined modes of medical cannabis delivery following regulatory changes in 2014 governing how Canadians access medical cannabis. A total of 364 approved adult Canadian medical cannabis users completed an online cross-sectional survey between April and June 2015. The survey examined patterns of medical cannabis use, modes of delivery used, and reasons for use. Participants were recruited through a convenience sample from nine Health Canada licensed producers. Using a vapourizer was the most popular mode of delivery for medical cannabis (53 %), followed by smoking a joint (47 %). The main reason for using a vapourizer was to reduce negative health consequences associated with smoking. A majority of current vapourizer users reported using a portable vapourizer (67.2 %), followed by a stationary vapourizer (41.7 %), and an e-cigarette or vape pen (19.3 %). Current use of a vapourizer was associated with fewer respiratory symptoms (AOR = 1.28, 95 % CI 1.05-1.56, p = 0.01). The findings suggest an increase in the popularity of vapourizers as the primary mode of delivery among approved medical users. Using vapourizers has the potential to prevent some of the adverse respiratory health consequences associated with smoking and may serve as an effective harm reduction method. Monitoring implications of such current and future changes to medical cannabis regulations may be beneficial to policymakers.

  14. Zeolite-like metal-organic frameworks with ana topology

    KAUST Repository

    Eddaoudi, Mohamed

    2017-04-20

    Embodiments of the present disclosure describe a zeolite-like metal-organic framework composition comprising a metal-organic framework composition with ana topology characterized by the formula [MIII(4, 5-imidazole dicarboxylic acid)2X(solvent)a]n wherein MIII comprises a trivalent cation of a rare earth element, X comprises an alkali metal element or alkaline earth metal element, and solvent comprises a guest molecule occupying pores. Embodiments of the present disclosure describe a method of separating paraffins comprising contacting a zeolite-like metal-organic framework with ana topology with a flow of paraffins, and separating the paraffins by size.

  15. Probabilistic risk assessment for six vapour intrusion algorithms

    NARCIS (Netherlands)

    Provoost, J.; Reijnders, L.; Bronders, J.; Van Keer, I.; Govaerts, S.

    2014-01-01

    A probabilistic assessment with sensitivity analysis using Monte Carlo simulation for six vapour intrusion algorithms, used in various regulatory frameworks for contaminated land management, is presented here. In addition a deterministic approach with default parameter sets is evaluated against

  16. Development of green vapour corrosion inhibitor

    Science.gov (United States)

    Asmara, Y. P.; Suraj, V.; Siregar, J. P.; Kurniawan, T.; Bachtiar, D.; Mohamed, N. M. Z. N.

    2017-10-01

    Corrosion control using inhibitor is an effective method to protect carbon steel from corrosion. Due to environmental toxicity of chemical inorganic corrosion inhibitors (synthetic), green inhibitors are potentially to develop. In atmospheric conditions, green vapour corrosion inhibitors are the best solutions to replace the uses of inorganic corrosion inhibitors. This research used chemical acid extraction from the key lime (citrus aurantiifolia) leaves and seeds. They are used as the main ingredients to produce this effective green corrosion inhibitor. The experiments investigated effects of corrosion inhibition on corrosion rate of low carbon steel in 3% NaCl solution using both fog salt chamber and electrochemical cell. Using salt fog chamber to represent atmospheric conditions, and corrosion rates are evaluated visually and calculated using weight loss methods. Corrosion rate on electrochemical cell were calculated using linear polarization resistance (LPR) methods. All of the experiments were set in natural conditions at pH 7. Using weight loss for three days exposure time, the efficiency of the inhibitor reached 82.39%.

  17. Water vapour diffusion resistance factor of Phyllostachys edulis (Moso bamboo)

    OpenAIRE

    Huang, P.; Latif, E.; Chang, W.-S.; Ansell, M.P.; Lawrence, M.

    2017-01-01

    This study measured the water vapour diffusion resistance factor of the Moso bamboo specimens in all directions of the cylindrical coordinate system at both internode parts and node parts. The measurement was conducted by the dry cup method. Major findings included three aspects. The water vapour diffusion resistance factor results of Moso bamboo specimens present a decreasing trend from the external surface to the internal surface in the radial directions. This fact may be attributed to the ...

  18. Increased Thermal Conductivity in Metal-Organic Heat Carrier Nanofluids

    OpenAIRE

    Manjula I. Nandasiri; Jian Liu; B. Peter McGrail; Jeromy Jenks; Herbert T. Schaef; Vaithiyalingam Shutthanandan; Zimin Nie; Paul F. Martin; Satish K. Nune

    2016-01-01

    Metal-organic heat carriers (MOHCs) are recently developed nanofluids containing metal-organic framework (MOF) nanoparticles dispersed in various base fluids including refrigerants (R245Fa) and methanol. Here, we report the synthesis and characterization of MOHCs containing nanoMIL-101(Cr) and graphene oxide (GO) in an effort to improve the thermo-physical properties of various base fluids. MOHC/GO nanocomposites showed enhanced surface area, porosity, and nitrogen adsorption compared with th...

  19. Accuracy of orbits for GPS atmospheric water vapour estimation

    Science.gov (United States)

    Dodson, A. H.; Baker, H. C.

    A major error source in GPS measurements for precise height applications is the wet path delay due to tropospheric water vapour. It has recently been demonstrated that the tropospheric Zenith Wet Delay (ZWD) can be estimated using the GPS data itself and converted to equivalent Integrated Water Vapour (IWV) content with little additional uncertainty (where 1 kg/m 2 IWV is equal to 1 mm Integrated Precipitable Water Vapour, and equates approximately to 6.5 mm ZWD). One of the major factors in achieving accurate estimates on a near real time basis (less than a few hours) is the availability of reliable, accurate orbits. Tests have therefore been performed investigating the accuracy of GPS water vapour estimates using a number of current, freely available, rapid and predicted orbits in comparison to the IGS precise ephemeris. Initial results indicate that rapid orbit water vapour estimates compare to better than 1 kg/m 2, and predicted orbit water vapour estimates at 1-6 kg/m 2 level, with significant improvement in estimates when they are differenced.

  20. Metal-organic framework MIL-101 as sorbent based on double-pumps controlled on-line solid-phase extraction coupled with high-performance liquid chromatography for the determination of flavonoids in environmental water samples.

    Science.gov (United States)

    Liu, Yue; Hu, Jia; Li, Yan; Li, Xiao-Shuang; Wang, Zhong-Liang

    2016-10-01

    A novel method with high sensitivity for the rapid determination of chrysin, apigenin and luteolin in environment water samples was developed by double-pumps controlled on-line solid-phase extraction (SPE) coupled with high-performance liquid chromatography (HPLC). In the developed technique, metal organic framework MIL-101 was synthesized and applied as a sorbent for SPE. The as-synthesized MIL-101 was characterized by scanning electron microscope, X-ray diffraction spectrometry, thermal gravimetric analysis and micropore physisorption analysis. The MIL-101 behaved as a fast kinetics in the adsorption of chrysin, apigenin and luteolin. On-line SPE of chrysin, apigenin and luteolin was processed by loading a sample solution at a flow rate of 1.0 mL/min for 10 min. The extracted analytes were subsequently eluted into a ZORBAX Bonus-RP analytical column (25 cm long × 4.6 mm i.d.) for HPLC separation under isocratic condition with a mobile phase (MeOH: ACN: 0.02 M H 3 PO 4 = 35:35:30) at a flow rate of 1.0 mL/min. Experimental conditions, including ionic strength, sample pH, sample loading rates, sample loading time and desorption analytes time, were further optimized to obtain efficient preconcentration and high-precision determination of the analytes mentioned above. The method achieved the merits of simplicity, rapidity, sensitivity, wide linear range and high sample throughput. The possible mechanism for the adsorption of flavonoids on MIL-101 was proposed. The developed method has been applied to determine trace chrysin, apigenin and luteolin in a variety of environmental water samples. © 2016 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  1. Mixed garnet laser for a water vapour DIAL

    Science.gov (United States)

    Treichel, Rainer; Strohmaier, Stephan; Nikolov, Susanne; Eichler, Hans-Joachim; Murphy, Eamonn

    2017-11-01

    For the water vapour DIAL "WALES" the wavelength regions around 935 nm, 942 nm and 944 nm have been identified as the most suitable wavelength ranges. These wavelengths can be obtained using opticalparametric-oscillators (OPOs), stimulated Raman shifters and the Ti-Sapphire laser but none of these systems could deliver all the needed parameters like beam quality, efficiency, pulse length and energy yet. Also these systems are comparably big and heavy making them less suitable for a satellite based application. A fourth possibility to achieve these wavelength ranges is to shift the quasi-3-level laser lines (938 nm and 946 nm) of the Nd:YAG laser by replacing aluminium and yttrium by other rare earth elements. Changes of the host lattice characteristics lead to a shift of the upper and lower laser levels. These modified crystals are summarized under the name of "Mixed Garnet" crystals. Only the Mixed Garnet lasers can be pumped directly with diode laser and use a direct approach to generate the required laser pulses without frequency conversion. Therefore no additional non-linear crystals or special pump lasers are needed and a higher electric to optical efficiency is expected as well as single frequency operation using spectral tuning elements like etalons. In a first phase such mixed garnet crystals had been grown and characterised. The outcome was the selection of the gadolinium-scandium garnet for the most suitable laser crystal. During a second phase the complete laser system with output energy about 18 mJ in single 20 ns pulses and up to 8 mJ in free running mode with a combined pulse width of 250 μs at 942 nm have been demonstrated. The results of the first laser operation and the achieved performance parameter are reported.

  2. Experimental and molecular docking investigation on metal-organic framework MIL-101(Cr) as a sorbent for vortex assisted dispersive micro-solid-phase extraction of trace 5-nitroimidazole residues in environmental water samples prior to UPLC-MS/MS analysis.

    Science.gov (United States)

    Lu, Nan; Wang, Ting; Zhao, Pan; Zhang, Lianjun; Lun, Xiaowen; Zhang, Xueli; Hou, Xiaohong

    2016-11-01

    In the presented work, metal-organic framework (MOF) material MIL-101(Cr) (MIL, Matérial Institute Lavoisier) was used as a sorbent for vortex assisted dispersive micro-solid-phase extraction (VA-D-μ-SPE) of trace amount of metronidazole (MNZ), ronidazole (RNZ), secnidazole (SNZ), dimetridazole (DMZ), tinidazole (TNZ), and ornidazole (ONZ) in different environmental water samples. Ultra-high-performance liquid chromatography coupled with tandem mass spectrometry (UPLC-MS/MS) was used to quantify the target analytes. The extraction conditions, including type of sorbents, amount of MIL-101(Cr), solution pH, extraction method, extraction time, effect of salt, and elution conditions were investigated. Upon the optimal conditions, the developed method showed an excellent extraction performance with the average recovery ranging from 75.2 to 98.8 %. Good sensitivity levels were achieved with the detection limits of 0.03∼0.06 μg/L and the quantitation limits of 0.09∼0.20 μg/L. The linear ranges were varied from 0.1 to 20 for SNZ and ONZ and from 0.2 to 40 μg/L for MNZ, RNZ, DMZ, and TNZ (r 2  > 0.992), and repeatability of the method was satisfactory with the relative standard deviations (RSD) <8 %. Ultimately, the applicability of the method was successfully confirmed by the extraction and determination of 5-nitroimidazoles (5-NDZs) in 12 real water samples, showing the positive findings of MNZ and TNZ ranging from 0.3 to 1.0 μg/L. Furthermore, molecular docking was applied to explain the molecular interactions and free binding energies between MIL-101(Cr) and 5-NDZs, providing a deep insight into the adsorption mechanism. The proposed method exhibited the advantages of simplicity, rapidly, less solvent consumption, ease of operation, higher sensitivity, and lower matrix effect. Graphical abstract Schematic diagram of the extraction process and molecular docking investigation.

  3. Solution and vapour deposited lead perovskite solar cells: Ecotoxicity from a life cycle assessment perspective

    DEFF Research Database (Denmark)

    Espinosa Martinez, Nieves; Serrano-Luján, Lucía; Urbina, Antonio

    2015-01-01

    We present a life cycle analysis (LCA) and an environmental impact analysis (EIA) of lead based perovskite solar cells prepared according to the two most successfully reported literature methods that comprise either vapour phase deposition or solution phase deposition. We have developed the inven......We present a life cycle analysis (LCA) and an environmental impact analysis (EIA) of lead based perovskite solar cells prepared according to the two most successfully reported literature methods that comprise either vapour phase deposition or solution phase deposition. We have developed...... the inventory for all the components employed for the two different device architectures that resemble respectively a traditional dye sensitised solar cell (DSSC) and an inverted polymer solar cell (OPV). We analyse the impacts from generation of 1 kWh of electricity and assume a lifetime of 1 year...... lead(II)halides is very limited compared to methylammoniumhalides employed. This applies during the raw materials extraction, synthesis of the starting materials and manufacture of the perovskite solar cells and from these points of view the lead based perovskite solar cells do not pose extra concerns...

  4. Towards the determination of sulfonamides in meat samples: A magnetic and mesoporous metal-organic framework as an efficient sorbent for magnetic solid phase extraction combined with high-performance liquid chromatography.

    Science.gov (United States)

    Xia, Lian; Liu, Lijie; Lv, Xiaoxia; Qu, Fei; Li, Guoliang; You, Jinmao

    2017-06-02

    A magnetic, mesoporous core/shell structured Fe 3 O 4 @JUC-48 nanocomposite was synthesized and employed as a magnetic solid phase extraction (MSPE) sorbent for the determination of trace sulfonamides (SAs) in meat samples. The synthesized nanocomposite was characterized by X-ray diffraction, Fourier transform infrared spectra, transmission electron microscopy, scanning electron microscopy, Brunner-Emmet-Teller, and vibrating sample magnetometry; the Fe 3 O 4 @JUC-48 nanocomposite exhibited a distinctive morphology, large surface area, high magnetism, open adsorption sites, and high chemical stability. By combining the optimized MSPE conditions with high performance liquid chromatography diode array detection, an accurate and sensitive method for the determination of 5 SAs, including sulfadiazine (SDZ), sulfathiazole (STZ), sulfamerazine (SMR), sulfamethazine (SMZ), and sulfamethoxypyridazine (SMP), was developed. The method exhibited good linearity in the range of 3.97-1000ng/g with R ranging from 0.9991 to 0.9994, high sensitivity with LODs ranging from 1.73 to 5.23ng/g, adequate recoveries between 76.1 and 102.6% with low relative standard deviations ranging from 2.1 to 6.4%, and high precision with RSD<4.5%. The Fe 3 O 4 @JUC-48 magnetic nanocomposite is a promising sorbent for the rapid and efficient extraction of SAs from complex biological samples such as chicken, pork, and shrimp. Copyright © 2017 Elsevier B.V. All rights reserved.

  5. Evaluation of a novel metal-organic framework as an adsorbent for the extraction of multiclass pesticides from coconut palm (Cocos nucifera L.): An analytical approach using matrix solid-phase dispersion and liquid chromatography.

    Science.gov (United States)

    de Jesus, Jemmyson Romário; Wanderley, Kaline Amaral; Alves Júnior, Severino; Navickiene, Sandro

    2017-08-01

    We report the synthesis, characterization, and application of [Zn(1,4-benzenedicarboxylate)(H 2 O) 2 ] n , Zn(1,4-benzenedicarboxylate) 0.99 (NH 2 -1,4-benzenedicarboxylate) 0.01 (H 2 O) 2 ] n , [Zn(1,4-benzenedicarboxylate) 0.95 (NH 2 -1,4-benzenedicarboxylate) 0.05 (H 2 O) 2 ] n , and [Zn(1,4-benzenedicarboxylate) 0.9 (NH 2 -1,4-benzenedicarboxylate) 0.1 (H 2 O) 2 ] n as sorbents for the extraction of multiclass pesticides from coconut palm. Liquid chromatography with ultraviolet diode array detection was used as the analysis technique, and the experiments were performed at one fortification level (0.1 μg/g). The recoveries were 47-67, 51-70, 58-72, and 64-76% for [Zn(1,4-benzenedicarboxylate)(H 2 O) 2 ] n , Zn(1,4-benzenedicarboxylate) 0.99 (NH 2 -1,4-benzenedicarboxylate) 0.01 (H 2 O) 2 ] n , [Zn(1,4-benzenedicarboxylate) 0.95 (NH 2 -1,4-benzenedicarboxylate) 0.05 (H 2 O) 2 ] n , and [Zn(1,4-benzenelate) 0.95 (NH 2 -1,4-benzenedicarboxylate) 0.05 (H 2 O) 2 ] n , and [Zn(1,4-benzenedicarboxylate) 0.9 (NH 2 -1,4-benzenedicarboxylate) 0.1 (H 2 O) 2 ] n , respectively, with relative standard deviation ranging from 1 to 7% (n = 3). Detection and quantification limits were 0.01-0.05 and 0.05-0.2 μg/g, respectively, for the different pesticides studied. The method developed was linear over the range tested (0.01-10.0 μg/g) with r 2  > 0.9991. A direct comparison of [Zn(1,4-benzenedicarboxylate) 0.9 (NH 2 -1,4-benzenedicarboxylate) 0.1 (H 2 O) 2 ] n with the commercially available neutral alumina showed that [Zn(1,4-benzenedicarboxylate) 0.9 (NH 2 -1,4-benzenedicarboxylate) 0.1 (H 2 O) 2 ] n was a similar extracting phase for the pesticides investigated. © 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  6. Retrieving mesospheric water vapour from observations of volume scattering radiances

    Directory of Open Access Journals (Sweden)

    P. Vergados

    2009-02-01

    Full Text Available This study examines the possibility for a theoretical approach in the estimation of water vapour mixing ratios in the vicinity of polar mesospheric clouds (PMC using satellite observations of Volume Scattering Radiances (VSR obtained at the wavelength of 553 nm. The PMC scattering properties perturb the underlying molecular Rayleigh scattered solar radiance of the background atmosphere. As a result, the presence of PMC leads to an enhancement in the observed VSR at the altitude of the layer; the PMC VSRs are superimposed on the exponentially decreasing with height Rayleigh VSR, of the PMC-free atmosphere. The ratio between the observed and the Rayleigh VSR of the background atmosphere is used to simulate the environment in which the cloud layer is formed. In addition, a microphysical model of ice particle formation is employed to predict the PMC VSRs. The initial water vapour profile is perturbed until the modelled VSRs match the observed, at which point the corresponding temperature and water vapour profiles can be considered as a first approximation of those describing the atmosphere at the time of the observations. The role of temperature and water vapour in the cloud formation is examined by a number of sensitivity tests suggesting that the water vapour plays a dominant role in the cloud formation in agreement with experimental results. The estimated water vapour profiles are compared with independent observations to examine the model capability in the context of this study. The results obtained are in a good agreement at the peak of the PMC layer although the radiance rapidly decreases with height below the peak. This simplified scenario indicates that the technique employed can give a first approximation estimate of the water vapour mixing ratio, giving rise to the VSR observed in the presence of PMC.

  7. (Vapour + liquid) equilibria of (fluoromethane + tetrafluoromethane) at the temperature 130.46 K

    OpenAIRE

    Fonseca, I. M. A.; Sardinha, G. G.; Lobo, Lélio Q.

    1998-01-01

    The total vapour pressure of binary liquid mixtures of (fluoromethane+tetrafluoromethane) has been measured at the temperature 130.46 K. Two partially miscible liquid phases were found. The excess molar Gibbs energy was calculated in the region where the two liquids are mutually soluble. For the hypothetical equimolar mixture,GEm01 (x=0.5)=846 Jmol-1. http://www.sciencedirect.com/science/article/B6WHM-45J58FM-1B/1/78724d9c4f932fc881a978011fc1d879

  8. Measurement and modeling of high-pressure (vapour + liquid) equilibria of (CO{sub 2} + alcohol) binary systems

    Energy Technology Data Exchange (ETDEWEB)

    Gutierrez, Jorge E.; Bejarano, Arturo [Departamento de Ingenieria Quimica y Ambiental, Universidad Tecnica Federico Santa Maria, Avda. Espana 1680, Valparaiso (Chile); Fuente, Juan C. de la, E-mail: juan.delafuente@usm.c [Departamento de Ingenieria Quimica y Ambiental, Universidad Tecnica Federico Santa Maria, Avda. Espana 1680, Valparaiso (Chile); Centro Regional de Estudios en Alimentos Saludables, Blanco 1623, Valparaiso (Chile)

    2010-05-15

    An apparatus based on a static-analytic method assembled in this work was utilized to perform high pressure (vapour + liquid) equilibria measurements with uncertainties estimated at <5%. Complementary isothermal (vapour + liquid) equilibria results are reported for the (CO{sub 2} + 1-propanol), (CO{sub 2} + 2-methyl-1-propanol), (CO{sub 2} + 3-methyl-1-butanol), and (CO{sub 2} + 1-pentanol) binary systems at temperatures of (313, 323, and 333) K, and at pressure range of (2 to 12) MPa. For all the (CO{sub 2} + alcohol) systems, it was visually monitored to insure that there was no liquid immiscibility at the temperatures and pressures studied. The experimental results were correlated with the Peng-Robinson equation of state using the quadratic mixing rules of van der Waals with two adjustable parameters. The calculated (vapour + liquid) equilibria compositions were found to be in good agreement with the experimental values with deviations for the mol fractions <0.12 and <0.05 for the liquid and vapour phase, respectively.

  9. Transition metal complexes supported on metal-organic frameworks for heterogeneous catalysts

    Energy Technology Data Exchange (ETDEWEB)

    Farha, Omar K.; Hupp, Joseph T.; Delferro, Massimiliano; Klet, Rachel C.

    2017-02-07

    A robust mesoporous metal-organic framework comprising a hafnium-based metal-organic framework and a single-site zirconium-benzyl species is provided. The hafnium, zirconium-benzyl metal-organic framework is useful as a catalyst for the polymerization of an alkene.

  10. Ethanol vapour induced dilated cardiomyopathy in chick embryos

    International Nuclear Information System (INIS)

    Kamran, K.; Khan, M.Y.; Minhas, L.A.

    2013-01-01

    Objective: To study the effects of ethanol vapour inhalation on the heart chambers of chick embryo. Methods: The case-control study was conducted at the College of Physicians and Surgeons Pakistan regional centre in Islamabad from January to October 2007. Both experimental and control groups were divided into three sub-groups each, based on the day of the sacrifice. Each group was dissected on day 7, day 10 and day 22 or hatching whichever was earlier. The experimental sub-groups sacrificed on day 7, day 10 and on hatching, were exposed to ethanol vapours till day 6, 9 and 9 of incubation respectively. The diameter of all 4 chambers was measured in experimental hearts and compared with age-matched controls. SPSS 10 was used for statistical analysis. Results: Ethanol vapour exposure caused widening of all heart chambers in the experimental chick embryos sacrificed on day 7 and day 10 compared to the controls. The chambers of newly hatched chick hearts showed dilatation in all the chambers except the left ventricle. Conclusion: Ethanol vapour exposure during development affects the heart, resulting in the widening of all heart chambers. The exposure is as dangerous as drinking alcohol. Alcohol vapour exposure during development leads to progressive dilatation in different heart chambers, producing dilated cardiomyopathy. (author)

  11. Hydrogen Storage in Metal-Organic Frameworks

    Energy Technology Data Exchange (ETDEWEB)

    Long, Jeffrey R. [Lawrence Berkeley National Lab. (LBNL), Berkeley, CA (United States)

    2016-04-28

    The design and characterization of new materials for hydrogen storage is an important area of research, as the ability to store hydrogen at lower pressures and higher temperatures than currently feasible would lower operating costs for small hydrogen fuel cell vehicles. In particular, metal-organic frameworks (MOFs) represent promising materials for use in storing hydrogen in this capacity. MOFs are highly porous, three-dimensional crystalline solids that are formed via linkages between metal ions (e.g., iron, nickel, and zinc) and organic molecules. MOFs can store hydrogen via strong adsorptive interactions between the gas molecules and the pores of the framework, providing a high surface area for gas adsorption and thus the opportunity to store hydrogen at significantly lower pressures than with current technologies. By lowering the energy required for hydrogen storage, these materials hold promise in rendering hydrogen a more viable fuel for motor vehicles, which is a highly desirable outcome given the clean nature of hydrogen fuel cells (water is the only byproduct of combustion) and the current state of global climate change resulting from the combustion of fossil fuels. The work presented in this report is the result of collaborative efforts between researchers at Lawrence Berkeley National Lab (LBNL), the National Institute of Standards and Technology (NIST), and General Motors Corporation (GM) to discover novel MOFs promising for H2 storage and characterize their properties. Described herein are several new framework systems with improved gravimetric and volumetric capacity to strongly bind H2 at temperatures relevant for vehicle storage. These materials were rigorously characterized using neutron diffraction, to determine the precise binding locations of hydrogen within the frameworks, and high-pressure H2 adsorption measurements, to provide a comprehensive picture of H2 adsorption at all relevant pressures. A

  12. Electron collision cross section sets of TMS and TEOS vapours

    Science.gov (United States)

    Kawaguchi, S.; Takahashi, K.; Satoh, K.; Itoh, H.

    2017-05-01

    Reliable and detailed sets of electron collision cross sections for tetramethylsilane [TMS, Si(CH3)4] and tetraethoxysilane [TEOS, Si(OC2H5)4] vapours are proposed. The cross section sets of TMS and TEOS vapours include 16 and 20 kinds of partial ionization cross sections, respectively. Electron transport coefficients, such as electron drift velocity, ionization coefficient, and longitudinal diffusion coefficient, in those vapours are calculated by Monte Carlo simulations using the proposed cross section sets, and the validity of the sets is confirmed by comparing the calculated values of those transport coefficients with measured data. Furthermore, the calculated values of the ionization coefficient in TEOS/O2 mixtures are compared with measured data to confirm the validity of the proposed cross section set.

  13. The radiative role of ozone and water vapour in the temperature annual cycle in the tropical tropopause layer

    Science.gov (United States)

    Ming, Alison; Maycock, Amanda; Hitchcock, Peter; Haynes, Peter

    2017-04-01

    The prominent annual cycle in temperatures (with maximum peak to peak amplitude of 8 K around 70 hPa and 6 K at 90 hPa) is a key feature of the tropical tropopause layer (TTL). There is also a strong annual cycle observed in both ozone and water vapour in the TTL, with the latter understood as a consequence of the temperature annual cycle. The radiative contributions of the annual cycle in ozone and water vapour to the temperature annual cycle are studied, first with a seasonally evolving fixed dynamical heating calculation (SEFDH) where the dynamical heating is assumed to be unaffected by the radiative heating. In this framework, the variations in ozone and water vapour derived from satellite data lead to variations in temperature that are respectively in phase and out of phase with the observed annual cycle. The ozone contribution is at the upper range of previous calculations. This difference in phasing can be understood from the fact that an increase in water vapour cools the TTL, predominantly through enhanced local emission, whereas an increase in ozone warms the TTL, mostly through enhanced absorption of upwelling longwave radiation from the troposphere. The relative phasing of the water vapour and ozone effects on temperature is further influenced by the fact that for water vapour there is a strong non-local effect on temperatures from variations in concentrations occurring in lower layers of the TTL. In contrast, for ozone it is the local variations in concentration that have the strongest impact on local temperature variations. The factors that determine the vertical structure of the annual cycle in temperature are also examined. Radiative damping time scales are shown to maximize over a broad layer centred on the cold point. Non-radiative processes in the upper troposphere are inferred to impose a strong constraint on temperature perturbations below 130 hPa. These effects, combined with the annual cycles in dynamical and radiative heating, which both

  14. Gas/vapour separation using ultra-microporous metal–organic frameworks: insights into the structure/separation relationship

    KAUST Repository

    Adil, Karim

    2017-05-30

    The separation of related molecules with similar physical/chemical properties is of prime industrial importance and practically entails a substantial energy penalty, typically necessitating the operation of energy-demanding low temperature fractional distillation techniques. Certainly research efforts, in academia and industry alike, are ongoing with the main aim to develop advanced functional porous materials to be adopted as adsorbents for the effective and energy-efficient separation of various important commodities. Of special interest is the subclass of metal-organic frameworks (MOFs) with pore aperture sizes below 5-7 Å, namely ultra-microporous MOFs, which in contrast to conventional zeolites and activated carbons show great prospects for addressing key challenges in separations pertaining to energy and environmental sustainability, specifically materials for carbon capture and separation of olefin/paraffin, acetylene/ethylene, linear/branched alkanes, xenon/krypton, etc. In this tutorial review we discuss the latest developments in ultra-microporous MOF adsorbents and their use as separating agents via thermodynamics and/or kinetics and molecular sieving. Appreciably, we provide insights into the distinct microscopic mechanisms governing the resultant separation performances, and suggest a plausible correlation between the inherent structural features/topology of MOFs and the associated gas/vapour separation performance.

  15. Intercomparison of TCCON and MUSICA Water Vapour Products

    Science.gov (United States)

    Weaver, D.; Strong, K.; Deutscher, N. M.; Schneider, M.; Blumenstock, T.; Robinson, J.; Notholt, J.; Sherlock, V.; Griffith, D. W. T.; Barthlott, S.; García, O. E.; Smale, D.; Palm, M.; Jones, N. B.; Hase, F.; Kivi, R.; Ramos, Y. G.; Yoshimura, K.; Sepúlveda, E.; Gómez-Peláez, Á. J.; Gisi, M.; Kohlhepp, R.; Warneke, T.; Dohe, S.; Wiegele, A.; Christner, E.; Lejeune, B.; Demoulin, P.

    2014-12-01

    We present an intercomparison between the water vapour products from the Total Carbon Column Observing Network (TCCON) and the MUlti-platform remote Sensing of Isotopologues for investigating the Cycle of Atmospheric water (MUSICA), two datasets from ground-based Fourier Transform InfraRed (FTIR) spectrometers with good global representation. Where possible, comparisons to radiosondes are also included. The near-infrared TCCON measurements are optimized to provide precise monitoring of greenhouse gases for carbon cycle studies; however, TCCON's retrievals also produce water vapour products. The mid-infrared MUSICA products result from retrievals optimized to give precise and accurate information about H2O, HDO, and δD. The MUSICA water vapour products have been validated by extensive intercomparisons with H2O and δD in-situ measurements made from ground, radiosonde, and aircraft (Schneider et al. 2012, 2014), as well as by intercomparisons with satellite-based H2O and δD remote sensing measurements (Wiegele et al., 2014). This dataset provides a valuable reference point for other measurements of water vapour. This study is motivated by the limited intercomparisons performed for TCCON water vapour products and limited characterisation of their uncertainties. We compare MUSICA and TCCON products to assess the potential for TCCON measurements to contribute to studies of the water cycle, water vapour's role in climate and use as a tracer for atmospheric dynamics, and to evaluate the performance of climate models. The TCCON and MUSICA products result from measurements taken using the same FTIR instruments, enabling a comparison with constant instrumentation. The retrieval techniques differ, however, in their method and a priori information. We assess the impact of these differences and characterize the comparability of the TCCON and MUSICA datasets.

  16. Desalination using spray tower and vapour compression refrigeration system

    International Nuclear Information System (INIS)

    Sathish Kumar, S.; Mani, A.

    2006-01-01

    A desalination system using a spray tower and Vapour Compression Refrigeration (VCR) system is proposed for obtaining fresh water from brackish water. In the spray tower, simultaneous heat and mass transfer take place between the brackish water and air, which results in the evaporation of the brackish water and humidification of the air. Fresh water is obtained from the humidified air by condensing the water vapour using a VCR system. Parametric studies were carried out to study the effect of various operational parameters on the fresh water production rate. (author)

  17. Spontaneuos and Parametric Processes in Warm Rubidium Vapours

    Directory of Open Access Journals (Sweden)

    Dąbrowski M.

    2014-12-01

    Full Text Available Warm rubidium vapours are known to be a versatile medium for a variety of experiments in atomic physics and quantum optics. Here we present experimental results on producing the frequency converted light for quantum applications based on spontaneous and stimulated processes in rubidium vapours. In particular, we study the efficiency of spontaneously initiated stimulated Raman scattering in the Λ-level configuration and conditions of generating the coherent blue light assisted by multi-photon transitions in the diamond-level configuration. Our results will be helpful in search for new types of interfaces between light and atomic quantum memories.

  18. On GPS Water Vapour estimation and related errors

    Science.gov (United States)

    Antonini, Andrea; Ortolani, Alberto; Rovai, Luca; Benedetti, Riccardo; Melani, Samantha

    2010-05-01

    Water vapour (WV) is one of the most important constituents of the atmosphere: it plays a crucial role in the earth's radiation budget in the absorption processes both of the incoming shortwave and the outgoing longwave radiation; it is one of the main greenhouse gases of the atmosphere, by far the one with higher concentration. In addition moisture and latent heat are transported through the WV phase, which is one of the driving factor of the weather dynamics, feeding the cloud systems evolution. An accurate, dense and frequent sampling of WV at different scales, is consequently of great importance for climatology and meteorology research as well as operational weather forecasting. Since the development of the satellite positioning systems, it has been clear that the troposphere and its WV content were a source of delay in the positioning signal, in other words a source of error in the positioning process or in turn a source of information in meteorology. The use of the GPS (Global Positioning System) signal for WV estimation has increased in recent years, starting from measurements collected from a ground-fixed dual frequency GPS geodetic station. This technique for processing the GPS data is based on measuring the signal travel time in the satellite-receiver path and then processing such signal to filter out all delay contributions except the tropospheric one. Once the troposheric delay is computed, the wet and dry part are decoupled under some hypotheses on the tropospheric structure and/or through ancillary information on pressure and temperature. The processing chain normally aims at producing a vertical Integrated Water Vapour (IWV) value. The other non troposheric delays are due to ionospheric free electrons, relativistic effects, multipath effects, transmitter and receiver instrumental biases, signal bending. The total effect is a delay in the signal travel time with respect to the geometrical straight path. The GPS signal has the advantage to be nearly

  19. Multifunctional Metal-Organic Frameworks for Photocatalysis.

    Science.gov (United States)

    Wang, Sibo; Wang, Xinchen

    2015-07-01

    Metal-organic frameworks (MOFs) have attracted significant research attention in diverse areas due to their unique physical and chemical characteristics that allow their innovative application in various research fields. Recently, the application of MOFs in heterogeneous photocatalysis for water splitting, CO2 reduction, and organic transformation have emerged, aiming at providing alternative solutions to address the world-wide energy and environmental problems by taking advantage of the unique porous structure together with ample physicochemical properties of the metal centers and organic ligands in MOFs. In this review, the latest progress in MOF-involved solar-to-chemical energy conversion reactions are summarized according to their different roles in the photoredox chemical systems, e.g., photocatalysts, co-catalysts, and hosts. The achieved progress and existing problems are evaluated and proposed, and the opportunities and challenges of MOFs and their related materials for their advanced development in photocatalysis are discussed and anticipated. © 2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  20. Nanomaterials derived from metal-organic frameworks

    Science.gov (United States)

    Dang, Song; Zhu, Qi-Long; Xu, Qiang

    2018-01-01

    The thermal transformation of metal-organic frameworks (MOFs) generates a variety of nanostructured materials, including carbon-based materials, metal oxides, metal chalcogenides, metal phosphides and metal carbides. These derivatives of MOFs have characteristics such as high surface areas, permanent porosities and controllable functionalities that enable their good performance in sensing, gas storage, catalysis and energy-related applications. Although progress has been made to tune the morphologies of MOF-derived structures at the nanometre scale, it remains crucial to further our knowledge of the relationship between morphology and performance. In this Review, we summarize the synthetic strategies and optimized methods that enable control over the size, morphology, composition and structure of the derived nanomaterials. In addition, we compare the performance of materials prepared by the MOF-templated strategy and other synthetic methods. Our aim is to reveal the relationship between the morphology and the physico-chemical properties of MOF-derived nanostructures to optimize their performance for applications such as sensing, catalysis, and energy storage and conversion.

  1. Text Mining Metal-Organic Framework Papers.

    Science.gov (United States)

    Park, Sanghoon; Kim, Baekjun; Choi, Sihoon; Boyd, Peter G; Smit, Berend; Kim, Jihan

    2018-02-26

    We have developed a simple text mining algorithm that allows us to identify surface area and pore volumes of metal-organic frameworks (MOFs) using manuscript html files as inputs. The algorithm searches for common units (e.g., m 2 /g, cm 3 /g) associated with these two quantities to facilitate the search. From the sample set data of over 200 MOFs, the algorithm managed to identify 90% and 88.8% of the correct surface area and pore volume values. Further application to a test set of randomly chosen MOF html files yielded 73.2% and 85.1% accuracies for the two respective quantities. Most of the errors stem from unorthodox sentence structures that made it difficult to identify the correct data as well as bolded notations of MOFs (e.g., 1a) that made it difficult identify its real name. These types of tools will become useful when it comes to discovering structure-property relationships among MOFs as well as collecting a large set of data for references.

  2. The water vapour radiometer of Paranal: homogeneity of precipitable water vapour from two years of operations

    Science.gov (United States)

    Kerber, Florian; Querel, Richard R.; Neureiter, Bianca

    2015-04-01

    A Low Humidity and Temperature Profiling (LHATPRO) microwave radiometer, manufactured by Radiometer Physics GmbH (RPG), is used to monitor sky conditions over ESO's Paranal observatory in support of VLT science operations. The unit measures several channels across the strong water vapour emission line at 183 GHz, necessary for resolving the low levels of precipitable water vapour (PWV) that are prevalent on Paranal (median ∼2.4 mm). The instrument consists of a humidity profiler (183-191 GHz), a temperature profiler (51-58 GHz), and an infrared camera (∼10 μm) for cloud detection. We present a statistical analysis of the homogeneity of all-sky PWV using 24 months of PWV observations. The question we tried to address was whether PWV is homogeneous enough across the sky such that service mode observations with the VLT can routinely be conducted with a user-provided constraint for PWV measured at zenith. We find the PWV over Paranal to be remarkably homogeneous across the sky down to 27.5° elevation with a median variation of 0.07 mm (rms). The homogeneity is a function of the absolute PWV but the relative variation is fairly constant at 2 to 3% (rms). Such variations will not be a significant issue for analysis of astronomical data. Users at ESO can specify PWV - measured at zenith - as an ambient constraint in service mode to enable, for instance, very demanding observations in the infrared. We conclude that in general it will not be necessary to add another observing constraint for PWV homogeneity to ensure integrity of observations. For demanding observations requiring very low PWV, where the relative variation is higher, the optimum support could be provided by observing with the LHATPRO in the same line-of-sight simultaneously. Such a mode of operations has already been tested but will have to be justified in terms of scientific gain before implementation can be considered. We plan to extend our analysis of PWV variations covering a larger parameters space

  3. Can painted glass felt or glass fibre cloth be used as vapour barrier?

    DEFF Research Database (Denmark)

    El-Khattam, Amira; Andersen, Mie Them; Hansen, Kurt Kielsgaard

    2014-01-01

    with a ventilated attic where the ceiling may be air tight but has no vapour barrier; post-insulation of the attic may cause the need for a vapour barrier. Placing a vapour barrier above the ceiling can be tiresome and it is difficult to ensure tightness. A simpler way is to paint a vapour barrier directly...... it is essential to know how much influence a surface treatment has on the water vapour transport. Traditionally, there has been most focus on paints that affect the permeability as little as possible. However, sometimes water vapour resistance is desirable. Especially, this is relevant in existing buildings...... on the ceiling e.g. as an ordinary paint. This paper presents the results of an investigation of the water vapour resistance of surface treatments which are commonly used in-door. The water vapour resistance was measured by the cup method. Aerated concrete was investigated with and without various surface...

  4. (Vapour + liquid) equilibria for the binary mixtures (1-propanol + dibromomethane, or + bromochloromethane, or + 1,2-dichloroethane or + 1-bromo-2-chloroethane) at T = 313.15 K

    International Nuclear Information System (INIS)

    Gil-Hernandez, V.; Garcia-Gimenez, P.; Otin, S.; Artal, M.; Velasco, I.

    2005-01-01

    Isothermal (vapour + liquid) equilibria (VLE) at 313.15 K have been measured for liquid 1-propanol + dibromomethane, or + bromochloromethane or + 1,2-dichloroethane or + 1-bromo-2-chloroethane mixtures. The VLE data were reduced using the Redlich-Kister equation taking into consideration the vapour phase imperfection in terms of the 2nd molar virial coefficients. The excess molar Gibbs free energies of all the studied mixtures are positive and ranging from 794 J·mol -1 for (1-propanol + bromochloromethane) and 1052 J·mol -1 for (1-propanol + 1-bromo-2-chloroethane), at x = 0.5. The experimental results are compared with modified UNIFAC predictions

  5. Recent Advances as Materials of Functional Metal-Organic Frameworks

    Directory of Open Access Journals (Sweden)

    Xiao-Lan Tong

    2013-01-01

    Full Text Available Metal-organic frameworks (MOFs, also known as hybrid inorganic-organic materials, represent an emerging class of materials that have attracted the imagination of solid-state chemists because MOFs combine unprecedented levels of porosity with a range of other functional properties that occur through the metal moiety and/or the organic ligand. The purpose of this critical review is to give a representative and comprehensive overview of the arising developments in the field of functional metal-organic frameworks, including luminescence, magnetism, and porosity through presenting examples. This review will be of interest to researchers and synthetic chemists attempting to design multifunctional MOFs.

  6. Upper tropospheric water vapour variability over tropical latitudes ...

    Indian Academy of Sciences (India)

    It is examined whether high resolution radiosonde measurements represent well the UTWV by comparing with different satellite based (Atmospheric Infrared Sounder (AIRS), Advanced Microwave Sounding Unit-B (AMSUB) and Microwave Limb Sounder (MLS)) water vapour measurements. Very good comparison in the ...

  7. Resonant CARS Spectroscopy of s-Tetrazine Vapour

    NARCIS (Netherlands)

    Aartsma, Thijs J.; Hesselink, Wim H.; Wiersma, Douwe A.

    1980-01-01

    CARS experiments on s-tetrazine vapour show that the eletronic resonance enhancement in the Q-branch is most effective for the lower J values. This suggests that the radiationless relaxation rate in the excited state increases with rotational quantum number. Delayed picosecond CARS experiments

  8. Atmospheric radio refractivity and water vapour density at Oshodi ...

    African Journals Online (AJOL)

    Some statistical analyses have been carried out on radiosonde data on atmospheric humidity taken during the period 1990-1993 at two meteorological stations, Oshodi (6° 32'N, 3° 21E) and Kano (12° 5N, 8° 52E) in Nigeria. Monthly means and standard deviations of columnar radio refractivity N and columnar water vapour ...

  9. ESA DUE GlobVapour water vapor products: Validation

    Science.gov (United States)

    Schneider, Nadine; Schröder, Marc; Lindstrot, Ramus; Preusker, Rene; Stengel, Martin; ESA DUE GlobVapour Consortium

    2013-05-01

    The main objective of the European Space Agency (ESA) Data User Element (DUE) GlobVapour project was the development of multi-annual global water vapor data sets. Since water vapour is a key climate variable it is important to have a good understanding of its behavior in the climate system. The ESA DUE GlobVapour project provides water vapor data, including error estimates, based on carefully calibrated and inter-calibrated satellite radiances in response to user requirements for long time series satellite observations. ESA DUE GlobVapour total columnar water vapor (TCWV) products derived from GOME/SCIA/GOME-2 (1996-2008) and SSM/I+MERIS (2003-2008) have been validated for the mentioned period, using satellite-based (AIRS, ATOVS) and ground-based measurements (radiosondes and microwave radiometer). The validation results are discussed in the following. The technical specifications on bias (1 kg/m2 for SSMI+MERIS and 2 kg/m2 for GOME/SCIA/GOME-2) are generally met. For more information, documents and data download follow the link: www.globvapour.info.

  10. ESA DUE GlobVapour water vapor products: Validation

    Energy Technology Data Exchange (ETDEWEB)

    Schneider, Nadine; Schroeder, Marc; Stengel, Martin [Deutscher Wetterdienst (DWD), KU22, Frankfurter Str. 135, 63067 Offenbach a. M (Germany); Lindstrot, Ramus; Preusker, Rene [Freie Universitaet Berlin (FUB), Carl-Heinrich-Becker-Weg 6-10, 12165 Berlin (Germany); Collaboration: ESA DUE GlobVapour Consortium

    2013-05-10

    The main objective of the European Space Agency (ESA) Data User Element (DUE) GlobVapour project was the development of multi-annual global water vapor data sets. Since water vapour is a key climate variable it is important to have a good understanding of its behavior in the climate system. The ESA DUE GlobVapour project provides water vapor data, including error estimates, based on carefully calibrated and inter-calibrated satellite radiances in response to user requirements for long time series satellite observations. ESA DUE GlobVapour total columnar water vapor (TCWV) products derived from GOME/SCIA/GOME-2 (1996-2008) and SSM/I+MERIS (2003-2008) have been validated for the mentioned period, using satellite-based (AIRS, ATOVS) and ground-based measurements (radiosondes and microwave radiometer). The validation results are discussed in the following. The technical specifications on bias (1 kg/m{sup 2} for SSMI+MERIS and 2 kg/m{sup 2} for GOME/SCIA/GOME-2) are generally met. For more information, documents and data download follow the link: www.globvapour.info.

  11. Condensation of water vapour on moss-dominated biological soil ...

    Indian Academy of Sciences (India)

    Physical and chemical analyses of the samples pointed to a greater porosity, high content of fine particles, and high salinity for BSC compared to the dune sand. These results highlight that soil physicochemical properties are the likely factors influencing the mechanism of water vapour condensation under specific ...

  12. Analysis of radiosonde data on tropospheric water vapour in Nigeria ...

    African Journals Online (AJOL)

    The analyses of some atmospheric water vapour parameters derived from radiosonde data at the three existing radiosonde stations in Nigeria are reported. The stations essentially represent the climates of the southern (coastal), middlebelt (savannah), and northern (sub-sahel) regions of the country. Monthly means of the ...

  13. Making ET AAS Determination Less Dependent on Vapourization ...

    African Journals Online (AJOL)

    In the analytical practice, the problem is normally bypassed by using reference materials with physical and chemical properties similar to those of the sample. The general solution of the problem comes from the integration of running absorbance normalized with regard to vapour transportation velocity. In this work, the ...

  14. Morphology of carbon nanotubes prepared via chemical vapour ...

    Indian Academy of Sciences (India)

    Small angle neutron scattering (SANS) has been utilized to study the morphology of the multi-walled carbon nanotubes prepared by chemical vapour deposition of acetylene. The effects of various synthesis parameters like temperature, catalyst concentration and catalyst support on the size distribution of the nanotubes are ...

  15. Vapour-liquid equilibria of the hard core Yukawa fluid

    NARCIS (Netherlands)

    Smit, B.; Frenkel, D.

    1991-01-01

    Techniques which extend the range of applicability of the Gibbs ensemble technique for particles which interact with a hard core potential are described. The power of the new technique is demonstrated in a numerical study of the vapour-liquid coexistence curve of the hard core Yukawa fluid.

  16. Estimation of vapour pressure and partial pressure of subliming ...

    Indian Academy of Sciences (India)

    Administrator

    temperature curves are calculated at 80, 160 and 1000 mbar for salicylic acid and vanadyl bis-2,4- pentanedionate, a precursor used for chemical vapour deposition of vanadium oxides. Using a modification of the Langmuir equation, the partial pressure of these materials at different total pressures is also determined.

  17. Erratum to: Measurement of copper vapour laser-induced ...

    Indian Academy of Sciences (India)

    2014-05-22

    May 22, 2014 ... Home; Journals; Pramana – Journal of Physics; Volume 82; Issue 6. Erratum to: Measurement of copper vapour laser-induced deformation of dielectric-coated mirror surface by Michelson interferometer. A Wahid S Kundu J S B Singh A K Singh A Khattar S K Maurya J S Dhumal K Dasgupta. Erratum ...

  18. Condensation of water vapour on moss-dominated biological soil ...

    Indian Academy of Sciences (India)

    Condensation of water vapour on moss-dominated biological soil crust, NW China. Xin-Ping Wang∗. , Yan-Xia Pan, Rui Hu, Ya-Feng Zhang and Hao Zhang. Shapotou Desert Research and Experiment Station, Cold and Arid Regions Environmental and Engineering. Research Institute, Chinese Academy of Sciences, 320, ...

  19. Water vapour and carbon dioxide decrease nitric oxide readings

    NARCIS (Netherlands)

    vanderMark, TW; Kort, E; Meijer, RJ; Postma, DS; Koeter, GH

    Measurement of nitric oxide levels in exhaled ah-is commonly performed using a chemiluminescence detector. However, water vapour and carbon dioxide affect the chemiluminescence process, The influence of these gases at the concentrations present in exhaled air has not vet been studied. For this in

  20. Vapour intrusion from the vadose zone—seven algorithms compared

    NARCIS (Netherlands)

    Provoost, J.; Bosman, A.; Reijnders, L.; Bronders, J.; Touchant, K.; Swartjes, F.

    2010-01-01

    Background, aim and scope: Vapours of volatile organic compounds (VOCs) emanating from contaminated soils may move through the unsaturated zone to the subsurface. VOC in the subsurface can be transported to the indoor air by convective air movement through openings in the foundation and basement.

  1. Carbon dioxide, water vapour and energy fluxes over a semi ...

    Indian Academy of Sciences (India)

    42

    vapour fluxes in Mangrove ecosystems, Sundarbans (India). The above observations are. 57 .... with the help of PAR. 115 sensor. Soil heat flux plates were used for the measurement of soil heat flux. ..... where Rn is net radiation, G is the soil heat flux, H is sensible heat flux and LE is the latent. 233 heat flux. 234. We have ...

  2. Detection of explosive vapour using surface-enhanced Raman spectroscopy

    Science.gov (United States)

    Fang, X.; Ahmad, S. R.

    2009-11-01

    A commercially available nano-structured gold substrate was used for activating surface-enhanced Raman scattering (SERS). Raman spectra of the vapour of explosive material, triacetonetriperoxide (TATP), at trace concentrations produced from adsorbed molecules on such surfaces have been studied. Prominent Raman lines of the explosive molecular species were recorded at a sample temperature of ˜35°C, which is near to human body temperature. For this study, the concentration of the adsorbed TATP molecules on the nano-structured surface was varied by heating the sample to different temperatures and exposing the substrate to the sample vapour for different lengths of time. The intensities of the Raman lines have been found to increase with the increase in temperature and also with the increase in the duration of exposure for a fixed temperature. However, as expected, the Raman intensities have been found to saturate at higher temperatures and longer exposures. These saturation effects of the strengths of the Raman lines in the SERS of TATP vapour have been investigated in this paper. The results indicate that the optimisation for vapour deposition on the surface could be a crucial factor for any quantitative estimate of the concentration of the molecular species adsorbed on the nano-structured substrates.

  3. Microscopic characterisation of suspended graphene grown by chemical vapour deposition

    NARCIS (Netherlands)

    Bignardi, L.; Dorp, W.F. van; Gottardi, S.; Ivashenko, O.; Dudin, P.; Barinov, A.; de Hosson, J.T.M.; Stöhr, M.; Rudolf, P.

    2013-01-01

    We present a multi-technique characterisation of graphene grown by chemical vapour deposition (CVD) and thereafter transferred to and suspended on a grid for transmission electron microscopy (TEM). The properties of the electronic band structure are investigated by angle-resolved photoelectron

  4. Human volunteer study with PGME: Eye irritation during vapour exposure

    NARCIS (Netherlands)

    Emmen, H.H.; Muijser, H.; Arts, J.H.E.; Prinsen, M.K.

    2003-01-01

    The objective of this study was to establish the possible occurrence of eye irritation and subjective symptoms in human volunteers exposed to propylene glycol monomethyl ether (PGME) vapour at concentrations of 0, 100 and 150 ppm. Testing was conducted in 12 healthy male volunteers using a repeated

  5. Carbon dioxide, water vapour and energy fluxes over a semi ...

    Indian Academy of Sciences (India)

    42

    1Department of Environmental Science, Tezpur Central University, Tezpur 784028, Assam,. India. 2Prince Of Wales Institute Of Engineering & Technology, Jorhat, Assam; 3Indian Institute. Of Tropical Meteorology, Pune; 4Savitribai Phule Pune University, Pune, India. Carbon dioxide, water vapour and energy fluxes over a ...

  6. Upper tropospheric water vapour variability over tropical latitudes ...

    Indian Academy of Sciences (India)

    Upper tropospheric water vapour variability over tropical latitudes observed using radiosonde and satellite measurements. Ghouse Basha1, M Venkat Ratnam1,∗ and B V Krishna Murthy2. 1National Atmospheric Research Laboratory (NARL), Department of Space, Government of India,. Gadanki, PB No. 123, Tirupati 517 ...

  7. Making ET AAS Determination Less Dependent on Vapourization ...

    African Journals Online (AJOL)

    NICO

    The quantification of the analytes in ET AAS is normally attained by the measurement and integration of transient absorbance. High degree of atomization and constant vapour transportation rate for the analyte atoms in the absorption volume are considered to be crucial to grant correctness of the measurements. However ...

  8. Erratum to: Measurement of copper vapour laser-induced ...

    Indian Academy of Sciences (India)

    Erratum to: Measurement of copper vapour laser-induced deformation of dielectric-coated mirror surface by. Michelson interferometer. A WAHID. ∗. , S KUNDU, J S B SINGH, A K SINGH, A KHATTAR,. S K MAURYA, J S DHUMAL and K DASGUPTA. Laser & Plasma Technology Division, Beam Technology Development ...

  9. Estimation of vapour pressure and partial pressure of subliming ...

    Indian Academy of Sciences (India)

    Administrator

    substance due to the flowing gas in the thermogravimetric analysis (TGA) apparatus was taken into account. ... the partial pressure, V the volume, n number of moles (of the vapour), R the universal gas constant and T the .... Figure 7. Molar concentration of vanadium metal as a func- tion of temperature at different pressures.

  10. Variation In Surface Water Vapour Density Over Four Nigerian Stations

    African Journals Online (AJOL)

    The surface water vapour density ρ has been studied using monthly averages of temperature and relative humidity at four selected weather stations in Nigeria for the years 1987 to 1991. It is found that during the dry season months of November to March, ρ is higher at night by an average of about 9.9% than during the day ...

  11. Carbon dioxide and water vapour characteristics on the west coast ...

    Indian Academy of Sciences (India)

    Carbon dioxide and water vapour in the atmo- sphere are considered as the green-house gases and responsible for the global warming, hence much attention has been given to its measurement and analysis (Jones et al. 1978; Jones and Smith 1977;. Leuning et al. 1982; Ohtaki and Matsui 1982;. Ohtaki 1985).

  12. Effect of paint on vapour resistivity in plaster

    Directory of Open Access Journals (Sweden)

    de Villanueva, L.

    2008-12-01

    Full Text Available The vapour resistivity of plaster coatings such as paint and their effectiveness as water repellents were studied in several types of plaster. To this end, painted, unpainted and pigmented specimens were tested. Experimental values were collected on diffusion and vapour permeability, or its inverse, water vapour resistivity.The data obtained were very useful for evaluating moisture exchange between plaster and the surrounding air, both during initial drying and throughout the life of the material. They likewise served as a basis for ensuring the proper evacuation of water vapour in walls, and use of the capacity of the porous network in plaster products to regulate moisture content or serve as a water vapour barrier to avoid condensation.Briefly, the research showed that pigments, water-based paints and silicon-based water repellents scantly raised vapour resistance. Plastic paints, enamels and lacquers, however, respectively induced five-, ten- and twenty-fold increases in vapour resistivity, on average.Se estudia el fenómeno de la resistividad al vapor de los de yeso y el efecto impermeabilizante que producen los recubrimientos de pintura sobre diversos tipos de yeso y escayola. Para ello, se ensayan probetas desnudas y recubiertas con distintos tipos de pintura, así como coloreados en masa. Se obtienen valores experimentales de la difusividad o permeabilidad al vapor o su inverso la resistividad al vapor de agua.Los datos obtenidos son muy útiles para valorar el fenómeno del intercambio de humedad entre el yeso y el ambiente, tanto durante el proceso de su secado inicial, como en el transcurso de su vida. Así como para disponer soluciones adecuadas para la evacuación del vapor de agua a través de los cerramientos, para utilizar la capacidad de regulación de la humedad, que proporciona el entramado poroso de los productos de yeso, o para impedir el paso del vapor de agua y evitar condensaciones.Como resumen de la investigación, se

  13. Ethanol vapour sensing properties of screen printed WO 3 thick films

    Indian Academy of Sciences (India)

    The ethanol vapour sensing properties of these thick films were investigated at different operating temperatures and ethanol vapour concentrations. The WO3 thick films exhibit excellent ethanol vapour sensing properties with a maximum sensitivity of ∼1424.6% at 400°C in air atmosphere with fast response and recovery ...

  14. Evaluating the vapour shift concept in agriculture: some aspects

    Science.gov (United States)

    Schmidt, S.; Metselaar, K.; van Dam, J. C.; Klik, A.

    2009-04-01

    Human population growth leads to an increasing pressure on freshwater resources. By 2050 Falkenmark et al. (2004) estimate a global water deficit for crop production of 5800 km3.y-1. This has important consequences for management of fresh water resources at different scales, and new strategies at different scales are required. One of the strategies suggested is that of managing crops in such a way that the use of rainfall and irrigation is shifted as much as possible from evaporation towards transpiration, a so-called vapour shift. The suggested savings are in the order of 330 km3.y-1, and are based on estimates of the magnitude of three processes: Reducing early season evaporation; increasing canopy cover; and increasing yield levels. The vapour shift concept was evaluated empirically, and in a simulation study. The empirical evaluation using results for wheat, maize, millet, cotton, and barley suggests the estimate of potential savings is 37% lower than the estimate by Falkenmark et al. (2004). The uncertainty is large and due to the limited number of experiments in which a separation of evapotranspiration in evaporation and transpiration has been made over the entire growing season. This suggests that theoretical support for the vapour shift concept should become more important. In the simulation approach two management options, mulching and planting density, are evaluated for a site in India for an irrigated wheat crop using a simulation approach for water limited crop yield. Given the simulation model used, and the management options investigated, the assumption implicit in the vapour shift concept - decreasing evaporation with increasing yield level - does not hold in irrigated areas, or in areas in which water is the most limiting factor. This suggests that vapour shift will be largest in those areas where nutrients and pests- and diseases are still limiting or reducing crop yields, and measures are taken to reduce those limitations.

  15. Influence of Cu as a catalyst on the properties of silicon nanowires synthesized by the vapour-solid-solid mechanism

    International Nuclear Information System (INIS)

    Arbiol, Jordi; Kalache, Billel; Cabarrocas, Pere Roca i; Morante, Joan Ramon; Morral, Anna Fontcuberta i

    2007-01-01

    Unlike typical Au used as a catalyst for the synthesis of silicon nanowires via the vapour-liquid-solid mechanism, Cu has been found to induce a synthesis process governed by the vapour-solid-solid mechanism. Moreover, the temperature window for obtaining high-quality wires with Cu has been found to be relatively smaller than that shown by the Au: from 600 to 650 deg. C. However, high-resolution transmission electron microscopy analysis reveals significant new properties of the nanowires obtained. They have the peculiarity of successively switching the silicon structure from diamond to the wurtzite phase along the growth direction. This change of the crystalline structure implies that it has an important impact on the transport properties and characteristics of electronic devices. The results will be important for the future integration and application of silicon, where electrical and thermal transport properties play a significant role

  16. Excess molar enthalpies and (vapour + liquid) equilibria for mixtures containing N,N-dialkylamides and α,ω-dichloroalkanes

    International Nuclear Information System (INIS)

    Garcia-Gimenez, P.; Martinez-Lopez, J.F.; Velasco, I.; Otin, S.

    2008-01-01

    Excess molar enthalpies H m E have been measured for liquid N,N-dimethylformamide or N,N-dimethylacetamide + 1,2-dichloroethane, or + 1,4-dichlorobutane, or + 1,6-dichlorohexane at T = 298.15 K and T = 308.15 K and isothermal (vapour + liquid) equilibria (VLE) have been determined for N,N-dimethylformamide or N,N-dimethylacetamide + 1,2-dichloroethane or + 1,4-dichlorobutane at T = 313.15 K and T = 323.15 K. The VLE data have been reduced using the Redlich-Kister equation taking into consideration the non-ideality of the vapour phase in terms of second molar virial coefficients

  17. Clearing the air: protocol for a systematic meta-narrative review on the harms and benefits of e-cigarettes and vapour devices.

    Science.gov (United States)

    MacDonald, Marjorie; O'Leary, Renee; Stockwell, Tim; Reist, Dan

    2016-05-21

    Under the shadow of the tobacco epidemic, the sale and use of e-cigarettes and other vapour devices is increasing dramatically. A contentious debate has risen within public health over the harms and benefits of these devices. Clearing the Air seeks to clarify the issues with a systematic review that informs the pressing regulatory and public health decisions to be made regarding these new products. Using an integrated knowledge translation approach, public health researchers and knowledge users will work collaboratively throughout the project. Our research questions are the following: (1) What are the health risks and benefits of vapour devices, and how do these compare to cigarettes? (2) What is the harm reduction potential of vapour devices for individuals, the environment, and society? (3) Does youth vapour device experimentation lead to cigarette use? (4) Can vapour devices be effective aids for tobacco cessation? and (5) What is the potential toxicity of second-hand vapour? We are using meta-narrative review to synthesize studies from diverse research traditions because of its capacity to address contestations around a topic. The project has six phases. In the planning phase, we finalized the research questions. In the search phase, we are locating academic publications and grey literature aided by a research librarian. The mapping phase involves categorizing these papers into research traditions to understand different perspectives on the evidence for each research question. In the appraisal phase, we will select and evaluate the relevant papers. Finally, in the synthesis phase, using analytic techniques unique to meta-narrative methodology, we will compare and contrast the evidence from different research traditions to answer our research questions, identifying overarching meta-narratives. In the final stage, the full team will draft recommendations to be disseminated through a variety of knowledge translation strategies. Meta-narrative synthesis has the

  18. Thin films of metal-organic compounds and metal nanoparticle ...

    Indian Academy of Sciences (India)

    Thin films based on two very different metal-organic systems are developed and some nonlinear optical ... capability of the nanoparticle-embedded polymer film is demonstrated. Keywords. Polar crystal; uniaxial ... systems promising candidates for a wide range of electronic, magnetic and optical applications. However ...

  19. Magnetic behaviour in metal-organic frameworks—Some recent ...

    Indian Academy of Sciences (India)

    The article describes the synthesis, structure and magnetic investigations of a series of metal-organic framework compounds formed with Mn+2 and Ni+2 ions. The structures, determined using the single crystal X-ray diffraction, indicated that the structures possess two- and three-dimensional structures with magnetically ...

  20. Thin films of metal-organic compounds and metal nanoparticle ...

    Indian Academy of Sciences (India)

    Thin films based on two very different metal-organic systems are developed and some nonlinear optical applications are explored. A family of zinc complexes which form perfectly polar assemblies in their crystalline state are found to organize as uniaxially oriented crystallites in vapor deposited thin films on glass substrate.

  1. Neutron powder diffraction of metal-organic frameworks for ...

    Indian Academy of Sciences (India)

    Abstract. We review recent structural studies that we have undertaken aimed at eluci- dating the fundamental properties of metal-organic framework materials and their inter- actions with hydrogen. We have shown that exposing coordinatively unsaturated metal centers can greatly enhance the hydrogen binding energy and ...

  2. Neutron powder diffraction of metal-organic frameworks for ...

    Indian Academy of Sciences (India)

    We review recent structural studies that we have undertaken aimed at elucidating the fundamental properties of metal-organic framework materials and their interactions with hydrogen. We have shown that exposing coordinatively unsaturated metal centers can greatly enhance the hydrogen binding energy and that they ...

  3. Excess enthalpies and (vapour + liquid) equilibrium data for the binary mixtures of dimethylsulphoxide with ketones

    International Nuclear Information System (INIS)

    Radhamma, M.; Venkatesu, P.; Rao, M.V. Prabhakara; Prasad, D.H.L.

    2007-01-01

    Excess enthalpies (H E ), at ambient pressure and T = 298.15 K, have been measured by using a solution calorimeter for the binary liquid mixtures of dimethyl sulphoxide (DMSO) with ketones, as a function of composition. The ketones chosen in the present investigation were methyl ethyl ketone (MEK), methyl isobutyl ketone (MIBK), and cyclohexanone (CH). The H E values are positive over the entire composition range for the three binary mixtures. Furthermore, the (vapour + liquid) equilibrium (VLE) was measured at 715 Torr for these mixtures, of different compositions, with the help of Swietoslawski-ebulliometer. The experimental temperature-mole fraction (t-x) data were used to compute Wilson parameters and then used to calculate the equilibrium vapour-phase compositions as well as the theoretical points for these binary mixtures. These Wilson parameters are used to calculate activity coefficients (γ) and these in turn to calculate excess Gibbs free energy (G E ). The intermolecular interactions and structural effects were analyzed on the basis of the measured and derived properties

  4. Methane storage in flexible metal-organic frameworks with intrinsic thermal management.

    Science.gov (United States)

    Mason, Jarad A; Oktawiec, Julia; Taylor, Mercedes K; Hudson, Matthew R; Rodriguez, Julien; Bachman, Jonathan E; Gonzalez, Miguel I; Cervellino, Antonio; Guagliardi, Antonietta; Brown, Craig M; Llewellyn, Philip L; Masciocchi, Norberto; Long, Jeffrey R

    2015-11-19

    As a cleaner, cheaper, and more globally evenly distributed fuel, natural gas has considerable environmental, economic, and political advantages over petroleum as a source of energy for the transportation sector. Despite these benefits, its low volumetric energy density at ambient temperature and pressure presents substantial challenges, particularly for light-duty vehicles with little space available for on-board fuel storage. Adsorbed natural gas systems have the potential to store high densities of methane (CH4, the principal component of natural gas) within a porous material at ambient temperature and moderate pressures. Although activated carbons, zeolites, and metal-organic frameworks have been investigated extensively for CH4 storage, there are practical challenges involved in designing systems with high capacities and in managing the thermal fluctuations associated with adsorbing and desorbing gas from the adsorbent. Here, we use a reversible phase transition in a metal-organic framework to maximize the deliverable capacity of CH4 while also providing internal heat management during adsorption and desorption. In particular, the flexible compounds Fe(bdp) and Co(bdp) (bdp(2-) = 1,4-benzenedipyrazolate) are shown to undergo a structural phase transition in response to specific CH4 pressures, resulting in adsorption and desorption isotherms that feature a sharp 'step'. Such behaviour enables greater storage capacities than have been achieved for classical adsorbents, while also reducing the amount of heat released during adsorption and the impact of cooling during desorption. The pressure and energy associated with the phase transition can be tuned either chemically or by application of mechanical pressure.

  5. Diurnal and seasonal variations of surface water vapour density ...

    African Journals Online (AJOL)

    Diurnal and seasonal variations of surface water vapour density over some meteorological stations in Nigeria. ... Ife Journal of Science ... the three Sahelian stations, was 5.29±0.39; while during the rainy season, they were 21.72±1.22, 19.60±0.12 and 19.47±0.07 for the Southern, Midland and Northern regions respectively.

  6. A Simple Approach to Enhance the Water Stability of a Metal-Organic Framework.

    Science.gov (United States)

    Shih, Yung-Han; Kuo, Yu-Ching; Lirio, Stephen; Wang, Kun-Yun; Lin, Chia-Her; Huang, Hsi-Ya

    2017-01-01

    A facile method to improve the feasibility of water-unstable metal-organic frameworks in an aqueous environment has been developed that involves imbedding in a polymer monolith. The effect of compartment type during polymerization plays a significant role in maintaining the crystalline structure and thermal stability of the MOFs, which was confirmed by powder X-ray diffraction (PXRD) and thermogravimetric analysis (TGA), respectively. The MOF-polymer composite prepared in a narrow compartment (column, ID 0.8 mm) has better thermal and chemical stability than that prepared in a broad compartment (vial, ID 7 mm). The developed MOF-polymer composite was applied as an adsorbent in solid-phase microextraction of nine non-steroidal anti-inflammatory drugs (NSAIDs) and could be used for extraction more than 30 times, demonstrating that the proposed approach has potential for industrial applications. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  7. Sinter-Resistant Platinum Catalyst Supported by Metal-Organic Framework

    Energy Technology Data Exchange (ETDEWEB)

    Kim, In Soo [Materials Science Division, Argonne National Lab, 9700 S Cass Ave. Argonne IL 60439 USA; Nanophotonics Center, Korea Institute of Science and Technology, Seoul 02792 South Korea; Li, Zhanyong [Department of Chemistry, Northwestern University, 2145 Sheridan Rd. Evanston IL 60208 USA; Zheng, Jian [Institute for Integrated Catalysis, Pacific Northwest National Lab, P.O. Box 999 Richland WA 99352 USA; Platero-Prats, Ana E. [X-ray Science Division, Argonne National Lab, 9700 S Cass Ave. Argonne IL 60439 USA; Mavrandonakis, Andreas [Department of Chemistry, University of Minnesota, 207 Pleasant St. SE Minneapolis MN 55455 USA; Pellizzeri, Steven [Chemical and Biomolecular Engineering, Clemson University, 205 Earle Hall Clemson SC 29634 USA; Ferrandon, Magali [Chemical Sciences and Engineering Division, Argonne National Lab, 9700 S. Cass Ave. Argonne IL 60439 USA; Vjunov, Aleksei [Institute for Integrated Catalysis, Pacific Northwest National Lab, P.O. Box 999 Richland WA 99352 USA; Gallington, Leighanne C. [X-ray Science Division, Argonne National Lab, 9700 S Cass Ave. Argonne IL 60439 USA; Webber, Thomas E. [Department of Chemistry, University of Minnesota, 207 Pleasant St. SE Minneapolis MN 55455 USA; Vermeulen, Nicolaas A. [Department of Chemistry, Northwestern University, 2145 Sheridan Rd. Evanston IL 60208 USA; Penn, R. Lee [Department of Chemistry, University of Minnesota, 207 Pleasant St. SE Minneapolis MN 55455 USA; Getman, Rachel B. [Chemical and Biomolecular Engineering, Clemson University, 205 Earle Hall Clemson SC 29634 USA; Cramer, Christopher J. [Department of Chemistry, University of Minnesota, 207 Pleasant St. SE Minneapolis MN 55455 USA; Chapman, Karena W. [X-ray Science Division, Argonne National Lab, 9700 S Cass Ave. Argonne IL 60439 USA; Camaioni, Donald M. [Institute for Integrated Catalysis, Pacific Northwest National Lab, P.O. Box 999 Richland WA 99352 USA; Fulton, John L. [Institute for Integrated Catalysis, Pacific Northwest National Lab, P.O. Box 999 Richland WA 99352 USA; Lercher, Johannes A. [Institute for Integrated Catalysis, Pacific Northwest National Lab, P.O. Box 999 Richland WA 99352 USA; Department of Chemistry and Catalysis Research Institute, Technische Universität München, Lichtenbergstrasse 4 85748 Garching Germany; Farha, Omar K. [Department of Chemistry, Northwestern University, 2145 Sheridan Rd. Evanston IL 60208 USA; Hupp, Joseph T. [Materials Science Division, Argonne National Lab, 9700 S Cass Ave. Argonne IL 60439 USA; Department of Chemistry, Northwestern University, 2145 Sheridan Rd. Evanston IL 60208 USA; Martinson, Alex B. F. [Materials Science Division, Argonne National Lab, 9700 S Cass Ave. Argonne IL 60439 USA

    2018-01-02

    Installed on the zirconia nodes of a metal-organic framework (MOF) NU-1000 via targeted vapor-phase synthesis. The catalytic Pt clusters, site-isolated by organic linkers, are shown to exhibit high catalytic activity for ethylene hydrogenation while exhibiting resistance to sintering up to 200 degrees C. In situ IR spectroscopy reveals the presence of both single atoms and few-atom clusters that depend upon synthesis conditions. Operando X-ray absorption spectroscopy and Xray pair distribution analyses reveal unique changes in chemical bonding environment and cluster size stability while on stream. Density functional theory calculations elucidate a favorable reaction pathway for ethylene hydrogenation with the novel catalyst. These results provide evidence that atomic layer deposition (ALD) in MOFs is a versatile approach to the rational synthesis of size-selected clusters, including noble metals, on a high surface area support.

  8. Comparison of Hexane Vapour Permeation in Two Different Polymeric Membranes via an Innovative In-line FID Detection Method

    Directory of Open Access Journals (Sweden)

    Z. Petrusová

    2017-07-01

    Full Text Available This manuscript presents a novel method for the analysis of vapour permeation through polymeric membranes based on in-line analysis of the permeate with an FID detector. The hexane vapour permeation was studied for two commercially available membranes, namely low-density polyethylene (LDPE and thin-film-composite polyamide (PA membrane. The hexane permeation was studied at temperatures of 25–45 °C, hexane vapour activity in the range of 0.2–0.8 and trans-membrane pressures of 5–50 kPa. Two fundamentally different membranes were chosen to demonstrate the potential and sensitivity of the permeation apparatus. Upon increasing the temperature from 25 to 45 °C, the flux in LDPE was found to increase almost fourfold over the whole activity range. The nonlinear increase of the flux with activity indicates plasticization of the polymer by hexane. Contrarily, the flux in the PA membrane increases almost linearly with activity, with only a minor upward curvature. Since the PA is far away from any phase transition, it is less temperature-dependent than LDPE. The activation energy for permeation demonstrates that the temperature dependence in the LDPE membrane is dominated by changes in diffusion, whereas it is dominated by changes in solubility in the PA membrane.

  9. Modelling of vapour explosion in a stratified geometry

    International Nuclear Information System (INIS)

    Brayer, Claude

    1994-01-01

    A vapour explosion is the explosive vaporisation of a volatile liquid in contact with another hotter liquid. Such a violent vaporisation requires an intimate mixing and a fine fragmentation of both liquids. Based on a synthesis of published experimental results, the author of this research thesis reports the development of a new physical model which describes the explosion. In this model, the explosion propagation is due to the propagation of the pressure wave associated with this this explosion, all along the vapour film which initially separates both liquids. The author takes the presence of water in the liquid initially located over the film into account. This presence of vapour explains experimental propagation rates. Another consequence, when the pressure wave passes, is an acceleration of liquids at different rates below and above the film. The author considers that a mixture layer then forms from the point of disappearance of the film, between both liquids, and that fragmentation is due to the turbulence in this mixture layer. This fragmentation model is then introduced into an Euler thermodynamic, three-dimensional and multi-constituents code of calculation, MC3D, to study the influence of fragmentation on thermal exchanges between the various constituents on the volatile liquid vaporisation [fr

  10. Vapour pressures of isobutane at T = (310 to 407) K

    International Nuclear Information System (INIS)

    Miyamoto, H.; Takemura, J.; Uematsu, M.

    2004-01-01

    Twenty-eight measurements of the vapour pressure for isobutane have been obtained by means of a metal-bellows variable volumometer at temperatures from 310 K to 407 K. The volume-fraction purity of isobutane used through the measurement was 0.9999. The expanded uncertainties (k = 2) in temperature and pressure measurements have been estimated to be less than ±4 mK and ±1.1 kPa, respectively. The agreement of the present measurements on various volumes of the bellows at the same temperature is almost within the absolute average deviations of ±0.2 kPa. The discrepancies between two series of the present measurement, in which the sample fillings and adopted platinum resistance thermometers are different, have also been confirmed as enough lower than the experimental uncertainty. Throughout the present study, the direct comparisons of the vapour-pressure measurements on the same temperatures with several points data from the literatures were made in order to assess the reliability of the present ones quantitatively. In addition, based on the present measurements as input data, the Wagner-type vapour-pressure correlation was provided, which was also used for the systematic comparisons between the present measurement and the literature data

  11. Magnesium isotope evidence that accretional vapour loss shapes planetary compositions

    Science.gov (United States)

    Hin, Remco C.; Coath, Christopher D.; Carter, Philip J.; Nimmo, Francis; Lai, Yi-Jen; Pogge von Strandmann, Philip A. E.; Willbold, Matthias; Leinhardt, Zoë M.; Walter, Michael J.; Elliott, Tim

    2017-09-01

    It has long been recognized that Earth and other differentiated planetary bodies are chemically fractionated compared to primitive, chondritic meteorites and, by inference, the primordial disk from which they formed. However, it is not known whether the notable volatile depletions of planetary bodies are a consequence of accretion or inherited from prior nebular fractionation. The isotopic compositions of the main constituents of planetary bodies can contribute to this debate. Here we develop an analytical approach that corrects a major cause of measurement inaccuracy inherent in conventional methods, and show that all differentiated bodies have isotopically heavier magnesium compositions than chondritic meteorites. We argue that possible magnesium isotope fractionation during condensation of the solar nebula, core formation and silicate differentiation cannot explain these observations. However, isotopic fractionation between liquid and vapour, followed by vapour escape during accretionary growth of planetesimals, generates appropriate residual compositions. Our modelling implies that the isotopic compositions of magnesium, silicon and iron, and the relative abundances of the major elements of Earth and other planetary bodies, are a natural consequence of substantial (about 40 per cent by mass) vapour loss from growing planetesimals by this mechanism.

  12. Magnesium isotope evidence that accretional vapour loss shapes planetary compositions.

    Science.gov (United States)

    Hin, Remco C; Coath, Christopher D; Carter, Philip J; Nimmo, Francis; Lai, Yi-Jen; Pogge von Strandmann, Philip A E; Willbold, Matthias; Leinhardt, Zoë M; Walter, Michael J; Elliott, Tim

    2017-09-27

    It has long been recognized that Earth and other differentiated planetary bodies are chemically fractionated compared to primitive, chondritic meteorites and, by inference, the primordial disk from which they formed. However, it is not known whether the notable volatile depletions of planetary bodies are a consequence of accretion or inherited from prior nebular fractionation. The isotopic compositions of the main constituents of planetary bodies can contribute to this debate. Here we develop an analytical approach that corrects a major cause of measurement inaccuracy inherent in conventional methods, and show that all differentiated bodies have isotopically heavier magnesium compositions than chondritic meteorites. We argue that possible magnesium isotope fractionation during condensation of the solar nebula, core formation and silicate differentiation cannot explain these observations. However, isotopic fractionation between liquid and vapour, followed by vapour escape during accretionary growth of planetesimals, generates appropriate residual compositions. Our modelling implies that the isotopic compositions of magnesium, silicon and iron, and the relative abundances of the major elements of Earth and other planetary bodies, are a natural consequence of substantial (about 40 per cent by mass) vapour loss from growing planetesimals by this mechanism.

  13. Surface polish of PLA parts in FDM using dichloromethane vapour

    Directory of Open Access Journals (Sweden)

    Jin Yifan

    2017-01-01

    Full Text Available Fused deposition modelling has become one of the most diffused rapid prototyping techniques, which is widely used to fabricate prototypes. However, further application of this technology is severely limited by poor surface roughness. Thus it is necessary to adopt some operations to improve surface quality. Chemical finishing is typically employed to finish parts in fused deposition modelling (FDM. The purpose of this paper is to decrease the surface roughness for polylactic acid (PLA parts in FDM. The chemical reaction mechanism during the treating process is analysed. Then NaOH solution and dichloromethane vapour are used to treat FDM specimens respectively. A 3D laser microscope has been applied to assess the effects in terms of surface topography and roughness. The experimental results show that treatment using dichloromethane vapour performs much better than NaOH solution. Compared with the untreated group, surface roughness obtained through vapour treatment decreases by 88 per cent. This research has been conducted to provide a better method to treat PLA parts using chemical reagents.

  14. Isothermal (vapour + liquid) equilibrium and thermophysical properties for (1-butyl-3-methylimidazolium iodide + 1-butanol) binary system

    International Nuclear Information System (INIS)

    Teodorescu, Mariana

    2015-01-01

    Highlights: • The (vapour + liquid) equilibrium has been investigated at T = (353.15, 363.15, 373.15) K. • The refractive index vs. composition was determined at T = (293.15, 298.15, 308.15) K. • The system presents S-shape abatement from ideality in terms of G E . • Refractive index deviations are positive and increase with increasing temperature. • Densities, surface tensions, dielectric permittivities have been predicted. - Abstract: Experimental isothermal (vapour + liquid) equilibrium (VLE) data are reported for the binary mixture containing 1-butyl-3-methylimidazolium iodide ([bmim]I) + 1-butanol at three temperatures: (353.15, 363.15, and 373.15) K, in the range of 0 to 0.22 liquid mole fraction of [bmim]I. Additionally, refractive index measurements have been performed at three temperatures: (293.15, 298.15 and 308.15) K in the whole composition range. Densities, excess molar volumes, surface tensions and surface tension deviations of the binary mixture were predicted by Lorenz–Lorentz (n D -ρ) mixing rule. Dielectric permittivities and their deviations were evaluated by known equations. (Vapour + liquid) equilibrium data were correlated with Wilson thermodynamic model while refractive index data with the 3-parameters Redlich–Kister equation by means of maximum likelihood method. For the VLE data, the real vapour phase behaviour by virial equation of state was considered. The studied mixture presents S-shaped abatement from the ideality. Refractive index deviations, surface tension deviations and dielectric permittivity deviations are positive, while excess molar volumes are negative at all temperatures and on whole composition range. The VLE data may be used in separation processes design, and the thermophysical properties as key parameters in specific applications

  15. Advancements, Challenges and Prospects of Chemical Vapour Pressure at Atmospheric Pressure on Vanadium Dioxide Structures

    Directory of Open Access Journals (Sweden)

    Charalampos Drosos

    2018-03-01

    Full Text Available Vanadium (IV oxide (VO2 layers have received extensive interest for applications in smart windows to batteries and gas sensors due to the multi-phases of the oxide. Among the methods utilized for their growth, chemical vapour deposition is a technology that is proven to be industrially competitive because of its simplicity when performed at atmospheric pressure (APCVD. APCVD’s success has shown that it is possible to create tough and stable materials in which their stoichiometry may be precisely controlled. Initially, we give a brief overview of the basic processes taking place during this procedure. Then, we present recent progress on experimental procedures for isolating different polymorphs of VO2. We outline emerging techniques and processes that yield in optimum characteristics for potentially useful layers. Finally, we discuss the possibility to grow 2D VO2 by APCVD.

  16. Oxidation of iron and of titanium nitride by hydrogen sulphide and water vapour

    International Nuclear Information System (INIS)

    Nardou, Francoise

    1980-01-01

    This research thesis reports the study of the kinetic mechanism of reactions in heterogeneous phases with gaseous release within the frame of metallic or ceramic material oxidation. The first part discusses the use of the linear law of sulfuration of iron by the H 2 S gas, and discusses the sulfuration mechanism. The second part addresses the oxidation of iron in an H 2 /H 2 O atmosphere between 800 and 1000 C. It notably studies the nature of the linear regime mentioned in the literature. The last part addresses the very different case of titanium nitride, and studies the influence of water vapour on the oxidation mechanism. A close correlation between kinetic results and morphological observations highlights an embrittlement of TiN by hydrogen which diffuses at grain boundaries [fr

  17. Vapour growth of Cd(Zn)Te columnar nanopixels into porous alumina

    International Nuclear Information System (INIS)

    Sochinskii, N.V.; Abellan, M.; Martin Gonzalez, M.; Saucedo, E.; Dieguez, E.; Briones, F.

    2006-01-01

    The vapour phase growth (VPG) of CdTe and Cd 1- x Zn x Te was performed in order to investigate the formation of Cd(Zn)Te columnar nanostructures, which could serve as a basis for micropixels usable for further development of X- and gamma-ray high-resolution imaging devices. The possibility to form the 'Cd(Zn)Te-in-porous alumina' nanostructures by VPG has been demonstrated. The Cd(Zn)Te crystals integrated into nanoporous alumina have shown to have photoluminescence properties compatible with those of the bulk crystals and planar epitaxial layers. Further investigations are going on to improve the structural quality of Cd(Zn)Te nanocrystals

  18. Using Peltier cells to study solid-liquid-vapour transitions and supercooling

    International Nuclear Information System (INIS)

    Torzo, Giacomo; Soletta, Isabella; Branca, Mario

    2007-01-01

    We propose an apparatus for teaching experimental thermodynamics in undergraduate introductory courses, using thermoelectric modules and a real-time data acquisition system. The device may be made at low cost, still providing an easy approach to the investigation of liquid-solid and liquid-vapour phase transitions and of metastable states (supercooling). The thermoelectric module (a technological evolution of the thermocouple) is by itself an interesting subject that offers a clear example of both thermo-electric (Seebeck effect) and electro-thermal (Peltier effect) energy transformation. We report here some cooling/heating measurements for several liquids and mixtures, including water, salt/water, ethanol/water and sodium acetate, showing how to evaluate the phenomena of freezing point depression and elevation, and how to evaluate the water latent heat

  19. Formation of calcium phosphates by vapour diffusion in highly concentrated ionic micro-droplets

    Energy Technology Data Exchange (ETDEWEB)

    Iafisco, M. [Alma Mater Studiorum Universita di Bologna, Dipartimento di Chimica ' ' G. Ciamician' ' , Via Selmi 2, 40126 Bologna (Italy); Universita del Piemonte Orientale, Dipartimento di Scienze Mediche, Via Solaroli 4, 28100 Novara (Italy); Delgado-Lopez, J.M.; Gomez-Morales, J.; Hernandez-Hernandez, M.A.; Rodriguez-Ruiz, I. [Laboratorio de Estudios Cristalograficos, IACT CSIC-UGR, Edificio Lopez Neyra, Avenida del Conocimiento, s/n 18100 Armilla (Spain); Roveri, N. [Alma Mater Studiorum Universita di Bologna, Dipartimento di Chimica ' ' G. Ciamician' ' , Via Selmi 2, 40126 Bologna (Italy)

    2011-08-15

    In this work we have used the sitting drop vapour diffusion technique, employing the ''crystallization mushroom '' to analyze the evolution of calcium phosphate crystallization in micro-droplets containing high initial concentrations of Ca{sup 2+} and HPO{sub 4}{sup 2-}. The decomposition of NH{sub 4}HCO{sub 3} solution produces vapours of NH{sub 3} and CO{sub 2} which diffuse through the droplets containing an aqueous solution of Ca(CH{sub 3}COO){sub 2} and (NH{sub 4}){sub 2}HPO{sub 4}. The result is the increase of pH by means of the diffusion of NH{sub 3} gas and the doping of the calcium phosphate with CO{sub 3}{sup 2-} ions by means of the diffusion of CO{sub 2} gas. The pH of the crystallization process is monitored and the precipitates at different times are characterized by XRD, FTIR, TGA, SEM and TEM techniques. The slow increase of pH and the high concentration of Ca{sup 2+} and HPO{sub 4}{sup 2-} in the droplets induce the crystallization of three calcium phosphate phases: dicalcium phosphate dihydrate (DCPD, brushite), octacalcium phosphate (OCP) and carbonate-hydroxyapatite (HA). The amount of HA nanocrystals with needle-like morphology and dimensions of about 100 nm, closely resembling the inorganic phase of bones, gradually increases, with the precipitation time up to 7 days, whereas the amount of DCPD, growing along the b axis, increases up to 3 days. Then, DCDP crystals start to hydrolyze yielding OCP nanoribbons and HA nanocrystals. (copyright 2011 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  20. Increased Thermal Conductivity in Metal-Organic Heat Carrier Nanofluids.

    Science.gov (United States)

    Nandasiri, Manjula I; Liu, Jian; McGrail, B Peter; Jenks, Jeromy; Schaef, Herbert T; Shutthanandan, Vaithiyalingam; Nie, Zimin; Martin, Paul F; Nune, Satish K

    2016-06-15

    Metal-organic heat carriers (MOHCs) are recently developed nanofluids containing metal-organic framework (MOF) nanoparticles dispersed in various base fluids including refrigerants (R245Fa) and methanol. Here, we report the synthesis and characterization of MOHCs containing nanoMIL-101(Cr) and graphene oxide (GO) in an effort to improve the thermo-physical properties of various base fluids. MOHC/GO nanocomposites showed enhanced surface area, porosity, and nitrogen adsorption compared with the intrinsic nanoMIL-101(Cr) and the properties depended on the amount of GO added. MIL-101(Cr)/GO in methanol exhibited a significant increase in the thermal conductivity (by approximately 50%) relative to that of the intrinsic nanoMIL-101(Cr) in methanol. The thermal conductivity of the base fluid (methanol) was increased by about 20%. The increase in the thermal conductivity of nanoMIL-101(Cr) MOHCs due to GO functionalization is explained using a classical Maxwell model.

  1. Nano-architecture of metal-organic frameworks

    Science.gov (United States)

    Milichko, Valentin A.; Zalogina, Anastasiia; Mingabudinova, Leila R.; Vinogradov, Alexander V.; Ubyivovk, Evgeniy; Krasilin, Andrei A.; Mukhin, Ivan; Zuev, Dmitry A.; Makarov, Sergey V.; Pidko, Evgeny A.

    2017-09-01

    Change the shape and size of materials supports new functionalities never found in the sources. This strategy has been recently applied for porous crystalline materials - metal-organic frameworks (MOFs) to create hollow nanoscale structures or mesostructures with improved functional properties. However, such structures are characterized by amorphous state or polycrystallinity which limits their applicability. Here we follow this strategy to create such nano- and mesostructures with perfect crystallinity and new photonics functionalities by laser or focused ion beam fabrication.

  2. Controlling Thermal Expansion: A Metal?Organic Frameworks Route

    OpenAIRE

    Balestra, Salvador R. G.; Bueno-Perez, Rocio; Hamad, Said; Dubbeldam, David; Ruiz-Salvador, A. Rabdel; Calero, Sofia

    2016-01-01

    Controlling thermal expansion is an important, not yet resolved, and challenging problem in materials research. A conceptual design is introduced here, for the first time, for the use of metal?organic frameworks (MOFs) as platforms for controlling thermal expansion devices that can operate in the negative, zero, and positive expansion regimes. A detailed computer simulation study, based on molecular dynamics, is presented to support the targeted application. MOF-5 has been selected as model m...

  3. Alkylamine functionalized metal-organic frameworks for composite gas separations

    Energy Technology Data Exchange (ETDEWEB)

    Long, Jeffrey R.; McDonald, Thomas M.; D' Alessandro, Deanna M.

    2018-01-09

    Functionalized metal-organic framework adsorbents with ligands containing basic nitrogen groups such as alkylamines and alkyldiamines appended to the metal centers and method of isolating carbon dioxide from a stream of combined gases and carbon dioxide partial pressures below approximately 1 and 1000 mbar. The adsorption material has an isosteric heat of carbon dioxide adsorption of greater than -60 kJ/mol at zero coverage using a dual-site Langmuir model.

  4. Factors affecting release of ethanol vapour in active modified atmosphere packaging systems for horticultural products

    Directory of Open Access Journals (Sweden)

    Weerawate Utto

    2014-04-01

    Full Text Available The active modified atmosphere packaging (active MAP system , which provides interactive postharvest control , using ethanol vapour controlled release, is one of the current interests in the development of active packaging for horticultural products. A number of published research work have discussed the relationship between the effectiveness of ethanol vapour and its concentration in the package headspace, including its effect on postharvest decay and physiological controls. This is of importance because a controlled release system should release and maintain ethanol vapour at effective concentrations during the desired storage period. A balance among the mass transfer processes of ethanol vapour in the package results in ethanol vapour accumulation in the package headspace. Key factors affecting these processes include ethanol loading, packaging material, packaged product and storage environment (temperature and relative h umidity. This article reviews their influences and discusses future work required to better understand their influences on ethanol vapour release and accumulations in active MAP.

  5. Comparison of interaction mechanisms of copper phthalocyanine and nickel phthalocyanine thin films with chemical vapours

    Science.gov (United States)

    Ridhi, R.; Singh, Sukhdeep; Saini, G. S. S.; Tripathi, S. K.

    2018-04-01

    The present study deals with comparing interaction mechanisms of copper phthalocyanine and nickel phthalocyanine with versatile chemical vapours: reducing, stable aromatic and oxidizing vapours namely; diethylamine, benzene and bromine. The variation in electrical current of phthalocyanines with exposure of chemical vapours is used as the detection parameter for studying interaction behaviour. Nickel phthalocyanine is found to exhibit anomalous behaviour after exposure of reducing vapour diethylamine due to alteration in its spectroscopic transitions and magnetic states. The observed sensitivities of copper phthalocyanine and nickel phthalcyanine films are different in spite of their similar bond numbers, indicating significant role of central metal atom in interaction mechanism. The variations in electronic transition levels after vapours exposure, studied using UV-Visible spectroscopy confirmed our electrical sensing results. Bromine exposure leads to significant changes in vibrational bands of metal phthalocyanines as compared to other vapours.

  6. Atomic layer epitaxy of compound semiconductors with metalorganic precursors

    Science.gov (United States)

    DenBaars, S. P.; Dapkus, P. D.

    1989-11-01

    Atomic layer epitaxy (ALE) is a relatively new growth technology for depositing compound semiconductors one monolayer at a time. By employing a new regime of metalorganic chemical vapor deposition (MOCVD) growth, in which saturated surface reactions control the growth, it is possible to alternately deposit monolayers of column III and column V elements so that only one monolayer of the III-V compound semiconductor is formed in every cycle of the deposition. The use of metalorganic precursors for ALE is of considerable importance since it allows the hybridization of ALE with the existing MOCVD technique. Several benefits can be realized by integrating the two technologies. Layers of critical thickness and uniformity requirements can be grown by ALE, while thicker epitaxial layers can be grown by MOCVD. Additional advantages are the "digital growth" nature of ALE which affords a high degree of thickness reproducibility, and the selective area growth potential of laser-assisted ALE (LALE). In this paper, ALE and LALE of GaAs is reviewed with an emphasis on the utilization of metalorganic precursors.

  7. Prediction of vapour-liquid equilibria for the kinetic study of processes based on synthesis gas

    Energy Technology Data Exchange (ETDEWEB)

    Di Serio, M.; Tesser, R.; Cozzolino, M.; Santacesaria, E. [Naples Univ., Napoli (Italy). Dept. of Chemistry

    2006-07-01

    Syngas is normally used in the production of a broad range of chemicals and fuels. In many of these processes multiphase reactors, gas-liquid or gas-liquid-solid are used. Kinetic studies in multiphase systems are often complicated by the non-ideal behaviour of reagents and/or products that are consistently partitioned between the liquid and the vapour phase. Moreover, as often kinetic data are collected in batch conditions for the liquid phase, activity coefficients of the partitioned components can consistently change during the time as a consequence of changing the composition of the reaction mixture. Therefore, it is necessary, in these cases, to known the vapor-liquid equilibria (VLE) in order to collect and to interpret correctly the kinetic data. The description of phase equilibria, at high pressures, is usually performed by means of an EOS (Equation of State) allowing the calculation of fugacity coefficients, for each component, in both phases and determining the partition coefficients but the EOS approach involves the experimental determination of the interaction parameters for all the possible binary system of the mixture. For multicomponent mixtures a complete experimental determination of vapourliquid equilibria is very hard, also considering the high pressure and temperatures used. Some predictive group contribution methods have been recently developed. In this paper, we will describe in detail the application of these methods to the methanol homologation, as an example, with the scope of determining more reliable kinetic parameters for this reaction. (orig.)

  8. Thermal stability of γ-Fe2O3 nanoparticles and their employment for sensing of acetone vapours

    Science.gov (United States)

    Luby, Š.; Ivančo, J.; Jergel, M.; Švec, P., Jr.; Kotlár, M.; Kostiuk, D.; Halahovets, J.; Kollár, J.; Mosnáček, J.; Majková, E.

    2017-12-01

    Stability of γ-Fe2O3 nanoparticles-based films upon an isochronal annealing in air was investigated by x-ray diffraction, differential scanning calorimetry, and thermogravimetry. The γ-α transformation temperature increased owing to the nanoscaling of Fe2O3; the higher stability of the γ phase was explained on the ground of the surface free energy of nanoparticles (with the size of about 6.4 nm). Further, chemiresistors based on the Fe2O3 nanoparticle bilayer prepared by the Langmuir-Schaefer method were fabricated and examined in terms of their sensitivity to acetone vapours down to 500 ppb concentration in air.

  9. Recent advances in metal-organic frameworks and covalent organic frameworks for sample preparation and chromatographic analysis.

    Science.gov (United States)

    Wang, Xuan; Ye, Nengsheng

    2017-12-01

    In the field of analytical chemistry, sample preparation and chromatographic separation are two core procedures. The means by which to improve the sensitivity, selectivity and detection limit of a method have become a topic of great interest. Recently, porous organic frameworks, such as metal-organic frameworks (MOFs) and covalent organic frameworks (COFs), have been widely used in this research area because of their special features, and different methods have been developed. This review summarizes the applications of MOFs and COFs in sample preparation and chromatographic stationary phases. The MOF- or COF-based solid-phase extraction (SPE), solid-phase microextraction (SPME), gas chromatography (GC), high-performance liquid chromatography (HPLC) and capillary electrochromatography (CEC) methods are described. The excellent properties of MOFs and COFs have resulted in intense interest in exploring their performance and mechanisms for sample preparation and chromatographic separation. © 2017 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

  10. Thermodynamic study on vapourization of niobium oxides from slag melts

    Science.gov (United States)

    Li, Qiujin

    The partitioning of niobium to slag and gaseous niobium oxide vapourizing from metal/slag may cause niobium losses and erratic recovery rates in steelmaking practices. Knowledge of the volatility and activities of niobium oxides in slag melts are of great value for both theoretical evaluation and practical applications in niobium microalloyed steels. Because of the multi-valence state of niobium ions in slags, the behaviour of niobium in metallurgical slags is complicated. So far, little systematic attempts have been made and activity data of niobium oxides in slags are extremely scarce. The aim of this study is to determine precise data on the vapour pressures of niobium oxides, and consequently, to obtain information on thermodynamic quantities of niobium oxides in slag melts. The thermodynamic properties of niobium oxide in CaO-SiO2-NbO x and CaO-SiO2-Al2O3-NbOx slag melts were determined by employing the transpiration method from 1800-1873K under a controlled atmosphere. To confirm the validity of the transpiration method for the measurement of thermodynamic properties, the binary alloy system silver-gold was chosen for a comparison with the same property which has been measured by other recognized procedures. The agreement with literature results confirmed that the measurement yields reliable results for thermodynamic activity data by the transpiration method. The vapourization of liquid Nb2O5 was studied as a function of partial pressure of oxygen in the system and this confirms that atmosphere control is the essential condition for the vapourization study. The gaseous niobium oxide species was verified to be NbO2; hence, Nb2O5 vapourizes by the reaction Nb2O 5 (l) =2NbO2(g) +1/202(g). Heat of vapourization was estimated by applying the second law method and comparison with the literature showed a fairly good agreement. The thermodynamic properties of niobium oxide in the slag system of CaO-SiO 2-NbOx and CaO-SiO2-Al2O3-NbO x were measured by varying the

  11. Isothermal (vapour + liquid) equilibria for (nitromethane or nitroethane + 1,4-dichlorobutane) binary systems at temperatures between (343.15 and 363.15) K

    International Nuclear Information System (INIS)

    Teodorescu, Mariana; Dragoescu, Dana; Gheorghe, Daniela

    2013-01-01

    Graphical abstract: Isothermal (vapour + liquid) equilibrium data for (nitromethane (1) + 1,4-dichlorobutane (2)) system at 343.15 K (●, ○), 353.15 K (▴, △), and 363.15 K (■, □); solid points: liquid phase, open points: vapour phase; (––) 4th order Redlich-Kister correlation; (--) Modified UNIFAC (Do) prediction. Highlights: ► Isothermal VLE data were reported for two binary systems at 3 temperatures. ► Correlation of VLE data was made with Redlich–Kister, Wilson, NRTL, UNIQUAC models. ► Thermodynamic consistency was check by Van Ness test proving very good VLE data. ► Modified UNIFAC (Do) model has to be improved for these types of VLE and G E systems. - Abstract: Isothermal (vapor + liquid) equilibrium data are reported for the binary mixtures containing (nitromethane or nitroethane + 1,4-dichlorobutane) at three temperatures, (343.15, 353.15, 363.15) K. The measurements were performed by means of an ebulliometer which allows sampling from both phases in equilibrium. The experimental data were correlated using the Redlich–Kister, Wilson, NRTL and UNIQUAC excess Gibbs energy models by means of maximum likelihood method, taking into account the vapour phase imperfection in terms of the second virial coefficients. Both systems are zeotropic and show positive deviations from ideal behaviour. The experimental VLE data are analysed in terms of the Modified UNIFAC (Do) model.

  12. Can painted glass felt or glass fibre cloth be used as vapour barrier?

    DEFF Research Database (Denmark)

    El-Khattam, Amira; Andersen, Mie Them; Kielsgaard Hansen, Kurt

    2014-01-01

    it is essential to know how much influence a surface treatment has on the water vapour transport. Traditionally, there has been most focus on paints that affect the permeability as little as possible. However, sometimes water vapour resistance is desirable. Especially, this is relevant in existing buildings...... on the ceiling e.g. as an ordinary paint. This paper presents the results of an investigation of the water vapour resistance of surface treatments which are commonly used in-door. The water vapour resistance was measured by the cup method. Aerated concrete was investigated with and without various surface...

  13. Room Temperature Detection of Benzene Vapours by Tin Oxide Nano Clusters

    Directory of Open Access Journals (Sweden)

    J. N. PANCHAL

    2015-07-01

    Full Text Available Thin films of tin oxide with nano clusters were deposited using Chemical Vapour Transport technique. The annealed films were used as sensor to detect benzene vapours at room temperature. The response was studied for the concentration range 300-1000 ppm. A comparative study of the response of the nano clustered films to benzene vapours in this range with the response of thin films of Indium tin oxide and tin oxide deposited by the physical vapour deposition method was taken up.

  14. The Seasonal Cycle of Water Vapour on Mars from Assimilation of Thermal Emission Spectrometer Data

    Science.gov (United States)

    Steele, Liam J.; Lewis, Stephen R.; Patel, Manish R.; Montmessin, Franck; Forget, Francois; Smith, Michael D.

    2014-01-01

    We present for the first time an assimilation of Thermal Emission Spectrometer (TES) water vapour column data into a Mars global climate model (MGCM). We discuss the seasonal cycle of water vapour, the processes responsible for the observed water vapour distribution, and the cross-hemispheric water transport. The assimilation scheme is shown to be robust in producing consistent reanalyses, and the global water vapour column error is reduced to around 2-4 pr micron depending on season. Wave activity is shown to play an important role in the water vapour distribution, with topographically steered flows around the Hellas and Argyre basins acting to increase transport in these regions in all seasons. At high northern latitudes, zonal wavenumber 1 and 2 stationary waves during northern summer are responsible for spreading the sublimed water vapour away from the pole. Transport by the zonal wavenumber 2 waves occurs primarily to the west of Tharsis and Arabia Terra and, combined with the effects of western boundary currents, this leads to peak water vapour column abundances here as observed by numerous spacecraft. A net transport of water to the northern hemisphere over the course of one Mars year is calculated, primarily because of the large northwards flux of water vapour which occurs during the local dust storm around L(sub S) = 240-260deg. Finally, outlying frost deposits that surround the north polar cap are shown to be important in creating the peak water vapour column abundances observed during northern summer.

  15. The Chemical Vapour Deposition of Tantalum - in long narrow channels

    DEFF Research Database (Denmark)

    Mugabi, James Atwoki

    use as a construction material for process equipment, with the cheaper alternative being the construction of equipment from steel and then protecting it with a thin but efficacious layer of tantalum. Chemical Vapour Deposition (CVD) is chosen as the most effective process to apply thin corrosion......Tantalum’s resistance to corrosion in hot acidic environments and its superior metallic properties have made it a prime solution as a construction material or protective coating to equipment intended for use in such harsh chemical and physical conditions. The high price of tantalum metal limits its...

  16. Water vapour loss threshold and induction of cholinergic urticaria.

    Science.gov (United States)

    Tupker, R A; Doeglas, H M

    1990-01-01

    A patient is described with cholinergic urticaria (CU) in whom the symptoms could be provoked by gustatory stimuli. The aim of this study was to investigate whether there is a threshold of sweating (monitored by skin water vapour loss (SVL) measurements) at which CU can be provoked. Provocations with lemon and sal-ammoniac liquorice induced transient sweating differing both in degree and duration. Only 'doubly salted' liquorice, which caused the most intense sweat response, resulted in urticarial lesions. This findings suggest a threshold dependency for the induction of CU. SVL measurement may be a useful method for the evaluation of sweating tests in CU patients.

  17. Isobaric (vapour + liquid) equilibria for sulfolane with toluene, ethylbenzene, and isopropylbenzene at 101.33 kPa

    International Nuclear Information System (INIS)

    Wang Zhengrong; Huang Lei; Xia Shuqian; Ma Peisheng

    2011-01-01

    Highlights: → The VLE data of toluene, ethylbenzene, isopropylbenzene with sulfolane were measured. → Both NRTL and UNIQUAC models can fit the experimental data well. → The new group interaction parameters of UNIFAC were regressed from the VLE data. → The estimated result shows that the group interaction parameters are reliable. - Abstract: Isobaric (vapour + liquid) equilibrium data have been measured for the (toluene + sulfolane), (ethylbenzene + sulfolane), and (isopropylbenzene + sulfolane) binary systems with a modified Rose-Williams still at 101.33 kPa. The experimental data of binary systems were well correlated by the non-random two-liquid (NRTL) and universal quasi-chemical (UNIQUAC) activity coefficient models for the liquid phase. All the experimental results passed the thermodynamic consistency test by the Herington method. Furthermore, the model UNIFAC (Do) group contribution method was used. Sulfolane is treated as a group (TMS), the new group interaction parameters for CH 2 -TMS, ACH-TMS and ACCH 2 -TMS were regressed from the VLE data of (toluene + sulfolane) and (ethylbenzene + sulfolane) binary systems. Then these group interaction parameters were used to estimate phase equilibrium data of the (isopropylbenzene + sulfolane) binary system. The results showed that the estimated data were in good agreement with the experimental values. The maximum and average absolute deviations of the temperature were 4.50 K and 2.39 K, respectively. The maximum and average absolute deviations for the vapour phase compositions of isopropylbenzene were 0.0237 and 0.0137, respectively.

  18. Isobaric (vapour + liquid) equilibria for sulfolane with toluene, ethylbenzene, and isopropylbenzene at 101.33 kPa

    Energy Technology Data Exchange (ETDEWEB)

    Wang Zhengrong; Huang Lei [Key Laboratory for Green Chemical Technology of State Education Ministry, School of Chemical Engineering and Technology, Tianjin University, Tianjin 300072 (China); Xia Shuqian, E-mail: shuqianxia@tju.edu.cn [Key Laboratory for Green Chemical Technology of State Education Ministry, School of Chemical Engineering and Technology, Tianjin University, Tianjin 300072 (China); Ma Peisheng [Key Laboratory for Green Chemical Technology of State Education Ministry, School of Chemical Engineering and Technology, Tianjin University, Tianjin 300072 (China)

    2011-12-15

    Highlights: > The VLE data of toluene, ethylbenzene, isopropylbenzene with sulfolane were measured. > Both NRTL and UNIQUAC models can fit the experimental data well. > The new group interaction parameters of UNIFAC were regressed from the VLE data. > The estimated result shows that the group interaction parameters are reliable. - Abstract: Isobaric (vapour + liquid) equilibrium data have been measured for the (toluene + sulfolane), (ethylbenzene + sulfolane), and (isopropylbenzene + sulfolane) binary systems with a modified Rose-Williams still at 101.33 kPa. The experimental data of binary systems were well correlated by the non-random two-liquid (NRTL) and universal quasi-chemical (UNIQUAC) activity coefficient models for the liquid phase. All the experimental results passed the thermodynamic consistency test by the Herington method. Furthermore, the model UNIFAC (Do) group contribution method was used. Sulfolane is treated as a group (TMS), the new group interaction parameters for CH{sub 2}-TMS, ACH-TMS and ACCH{sub 2}-TMS were regressed from the VLE data of (toluene + sulfolane) and (ethylbenzene + sulfolane) binary systems. Then these group interaction parameters were used to estimate phase equilibrium data of the (isopropylbenzene + sulfolane) binary system. The results showed that the estimated data were in good agreement with the experimental values. The maximum and average absolute deviations of the temperature were 4.50 K and 2.39 K, respectively. The maximum and average absolute deviations for the vapour phase compositions of isopropylbenzene were 0.0237 and 0.0137, respectively.

  19. Metal-adeninate vertices for the construction of an exceptionally porous metal-organic framework.

    Science.gov (United States)

    An, Jihyun; Farha, Omar K; Hupp, Joseph T; Pohl, Ehmke; Yeh, Joanne I; Rosi, Nathaniel L

    2012-01-03

    Metal-organic frameworks comprising metal-carboxylate cluster vertices and long, branched organic linkers are the most porous materials known, and therefore have attracted tremendous attention for many applications, including gas storage, separations, catalysis and drug delivery. To increase metal-organic framework porosity, the size and complexity of linkers has increased. Here we present a promising alternative strategy for constructing mesoporous metal-organic frameworks that addresses the size of the vertex rather than the length of the organic linker. This approach uses large metal-biomolecule clusters, in particular zinc-adeninate building units, as vertices to construct bio-MOF-100, an exclusively mesoporous metal-organic framework. Bio-MOF-100 exhibits a high surface area (4,300 m(2) g(-1)), one of the lowest crystal densities (0.302 g cm(-3)) and the largest metal-organic framework pore volume reported to date (4.3 cm(3) g(-1)).

  20. Water vapour source impacts on oxygen isotope variability in tropical precipitation during Heinrich events

    Directory of Open Access Journals (Sweden)

    S. C. Lewis

    2010-06-01

    Full Text Available Water isotope records such as speleothems provide extensive evidence of past tropical hydrological changes. During Heinrich events, isotopic changes in monsoon regions have been interpreted as implying a widespread drying through the Northern Hemisphere tropics and an anti-phased precipitation response in the south. Here, we examine the sources of this variability using a water isotope-enabled general circulation model, Goddard Institute for Space Studies ModelE. We incorporate a new suite of vapour source distribution tracers to help constrain the impact of precipitation source region changes on the isotopic composition of precipitation and to identify nonlocal amount effects. We simulate a collapse of the North Atlantic meridional overturning circulation with a large freshwater input to the region as an idealised analogue to iceberg discharge during Heinrich events. An increase in monsoon intensity, defined by vertical wind shear, is modelled over the South American domain, with small decreases simulated over Asia. Simulated isotopic anomalies agree well with proxy climate records, with lighter isotopic values simulated over South America and enriched values across East Asia. For this particular abrupt climate event, we identify which climatic change is most likely linked to water isotope change – changes in local precipitation amount, monsoon intensity, water vapour source distributions or precipitation seasonality. We categorise individual sites according to the climate variability that water isotope changes are most closely associated with, and find that the dominant isotopic controls are not consistent across the tropics – simple local explanations, in particular, fall short of explaining water isotope variability at all sites. Instead, the best interpretations appear to be site specific and often regional in scale.

  1. Sound speed of isobaric heat capacity in the saturated and superheated vapour of cesium, rubidium and potassium

    International Nuclear Information System (INIS)

    Novikov, I.I.; Roschupkin, V.V.

    1985-01-01

    The paper reviews the work carried out on the thermodynamic properties of alkali metal vapours. The most systematic investigations concern the sound velocity measurements for saturated and superheated vapours of caesium, for saturated vapour of rubidium, and for superheated vapour of potassium. The Joule-Thompson coefficient has been studied in caesium vapour, and the isobaric heat capacity of potassium vapour has also been examined. The experimental methods for all these experiments are described, and the data obtained are presented in tabular form. (U.K.)

  2. Epitaxial Oxide Thin Films Grown by Solid Source Metal-Organic Chemical Vapor Deposition.

    Science.gov (United States)

    Lu, Zihong

    1995-01-01

    The conventional liquid source metal-organic chemical vapor deposition (MOCVD) technique is capable of producing large area, high quality, single crystal semiconductor films. However, the growth of complex oxide films by this method has been hampered by a lack of suitable source materials. While chemists have been actively searching for new source materials, the research work reported here has demonstrated the successful application of solid metal-organic sources (based on tetramethylheptanedionate) to the growth of high quality thin films of binary compound cerium dioxide (CeO_2), and two more complex materials, the ternary compound lithium niobate (LiNbO_3), with two cations, and the quaternary compound strontium barium niobate (SBN), with three cations. The growth of CeO_2 thin films on (1012)Al_2O_3 substrates has been used as a model to study the general growth behavior of oxides. Factors affecting deposition rate, surface morphology, out-of-plane mosaic structure, and film orientation have been carefully investigated. A kinetic model based on gas phase prereaction is proposed to account for the substrate temperature dependence of film orientation found in this system. Atomically smooth, single crystal quality cerium dioxide thin films have been obtained. Superconducting YBCO films sputtered on top of solid source MOCVD grown thin cerium dioxide buffer layers on sapphire have been shown to have physical properties as good as those of YBCO films grown on single crystal MgO substrates. The thin film growth of LiNbO_3 and Sr_{1-x}Ba _{x}Nb_2 O_6 (SBN) was more complex and challenging. Phase purity, transparency, in-plane orientation, and the ferroelectric polarity of LiNbO _3 films grown on sapphire substrates was investigated. The first optical quality, MOCVD grown LiNbO _3 films, having waveguiding losses of less than 2 dB/cm, were prepared. An important aspect of the SBN film growth studies involved finding a suitable single crystal substrate material. Mg

  3. Pulmonary CT findings in acute mercury vapour exposure

    Energy Technology Data Exchange (ETDEWEB)

    Hashimoto, Manabu; Sato, Kimihiko; Heianna, Jyouiti; Hirano, Yoshinori; Omachi, Kohiti; Izumi, Jyunichi; Watarai, Jiro

    2001-01-01

    AIM: We describe the pulmonary computed tomography (CT) findings in acute mercury poisoning. MATERIALS AND METHODS: Initial (n= 8) and follow-up (n= 6) chest CT examinations in eight patients exposed to mercury vapour while cutting pipes in a sulphuric acid plant were reviewed. Of the eight patients, two were asymptomatic and had normal CT results, two were asymptomatic but had abnormalities on CT, and four had both acute symptoms and positive CT results. The patients were all men whose ages ranged from 37 to 54 years (mean, 49 years). RESULTS: Poorly defined nodules were present in five of six patients with positive CT findings, present alone in two patients or as part of a mixed pattern in three. They were random in distribution. Alveolar consolidation (n= 3) and areas of ground-glass opacity (n= 4) were observed and were more prominent in the most severely affected patients with the highest blood and urine level of mercury, predominantly in the upper and/or middle zone. These abnormal findings on CT resolved with (n= 1) or without (n= 5) steroid therapy. Pathological findings (n= 1) demonstrated acute interstitial changes predominantly with oedema. CONCLUSION: We report CT findings in eight patients acutely exposed to mercury vapour. The pulmonary injury was reversible on CT in these cases. Hashimoto, M. (2001)

  4. First Townsend coefficient of organic vapour in avalanche counters

    International Nuclear Information System (INIS)

    Sernicki, J.

    1990-01-01

    A new concept is presented in the paper for implementing the proven method of determining the first Townsend coefficient (α) of gases using an avalanche counter. The A and B gas constants, interrelated by the expression α/p=A exp[-B/(K/p)], are analyzed. Parallel-plate avalanche counters (PPAC) with an electrode spacing d from 0.1 to 0.4 cm have been employed for the investigation, arranged to register low-energy alpha particles at n-heptane vapour pressures of p≥5 Torr. An in-depth discussion is given, covering the veracity and the behaviour vs K/p, of the n-heptane A and B constants determined at reduced electric-field intensity values ranging from 173.5 to 940 V/cm Torr; the constants have been found to depend upon d. The results of the investigation are compared to available data of the α coefficient of organic vapours used in avalanche counters. The PPAC method of determining α reveals some imperfections at very low values of the pd product. (orig.)

  5. A miniature discriminating monitor for tritiated water vapour

    Energy Technology Data Exchange (ETDEWEB)

    Edwards, R.A.H.; Ravazzani, A.; Pacenti, P. [European Commission, JRC, Institute for Advanced Material, Ispra, Vatican City State, Holy See (Italy); Campi, F. [Nuclear Engineering Dept., Polytechnic of Milan (Italy)

    1998-07-01

    In detecting tritium in air (or other gas) for worker safety, it is important to discriminate between tritiated water vapour and elemental tritium, because the first is much more easily absorbed in the lungs. We haveinvented (patent pending) an innovative discriminating monitor which works better than existing designs, and is much smaller. The air (or other sample gas) passes over a large surface area of solid scintillator, which is surface-treated to make it hygroscopic. Tritiated water vapour in the air exchanges continuously, rapidly and reversibly with the water in the thin hygroscopic layer; which is of the order of 1 micron thick. The beta-emissions from tritium in the hygroscopic layer hit the solid scintillator, causing flashes of light that are detected by a photomultiplier. The new discriminating monitor for tritiated species in air offers superior performance to existing discriminating monitors, and is much smaller. It is planned to develop a portable version which could serve as a personal tritium monitor. (authors)

  6. Thermally decarboxylated sodium bicarbonate: Interactions with water vapour, calorimetric study

    Directory of Open Access Journals (Sweden)

    Natalia Volkova

    2013-06-01

    Full Text Available Isothermal titration calorimetry (ITC was used to study interactions between water vapour and the surface of thermally converted sodium bicarbonate (NaHCO3. The decarboxylation degree of the samples was varied from 3% to 35% and the humidity range was 54–100%. The obtained enthalpy values were all exothermic and showed a positive linear correlation with decarboxylation degrees for each humidity studied. The critical humidity, 75% (RHo, was determined as the inflection point on a plot of the mean−ΔHkJ/mole Na2CO3 against RH. Humidities above the critical humidity lead to complete surface dissolution. The water uptake (m was determined after each calorimetric experiment, complementing the enthalpy data. A mechanism of water vapour interaction with decarboxylated samples, including the formation of trona and Wegscheider’s salt on the bicarbonate surface is proposed for humidities below RHo. Keywords: Isothermal titration calorimetry, Sodium bicarbonate, Sodium carbonate, Trona salt, Wegscheider’s salt, Enthalpy, Relative humidity, Pyrolytic decarboxylation

  7. Study of water vapour adsorption kinetics on aluminium oxide materials

    Science.gov (United States)

    Livanova, Alesya; Meshcheryakov, Evgeniy; Reshetnikov, Sergey; Kurzina, Irina

    2017-11-01

    Adsorbents on the basis of active aluminum oxide are still of demand on the adsorbent-driers market. Despite comprehensive research of alumina adsorbents, and currently is an urgent task to improve their various characteristics, and especially the task of increasing the sorption capacity. In the present work kinetics of the processes of water vapours' adsorption at room temperature on the surface of desiccant samples has been studied. It was obtained on the basis of bayerite and pseudoboehmite experimentally. The samples of pseudoboehmite modified with sodium and potassium ions were taken as study objects. The influence of an adsorbent's grain size on the kinetics of water vapours' adsorption was studied. The 0.125-0.25 mm and 0.5-1.0 mm fractions of this sample were used. It has been revealed that the saturation water vapor fine powder (0.125-0.25 mm) is almost twofold faster in comparison with the sample of fraction 0.5-1.0 mm due to the decrease in diffusion resistance in the pores of the samples when moving from the sample of larger fraction to the fine-dispersed sample. It has been established that the adsorption capacity of the pseudoboehmite samples, modified by alkaline ions, is higher by ˜40 %, than for the original samples on the basis of bayerite and pseudoboehmite.

  8. Vapour pressures of n-hexane determined by comparative ebulliometry

    Energy Technology Data Exchange (ETDEWEB)

    Ewing, Michael B. [Department of Chemistry, University College London, 20 Gordon Street, London WC1H 0AJ (United Kingdom)]. E-mail: m.b.ewing@ucl.ac.uk; Sanchez Ochoa, Jesus C. [Department of Chemistry, University College London, 20 Gordon Street, London WC1H 0AJ (United Kingdom)

    2006-03-15

    The vapour pressures of n-hexane have been measured using comparative ebulliometry with water as the reference fluid. The measurements cover the temperature and pressure range (315.7 K, 41.1 kPa) to (504.0 K, 2876.8 kPa) and join smoothly with results selected from the literature to provide consistent results down to (289.7 K, 13.8 kPa). The combined data set have been described by a Wagner style equation with a fractional standard deviation of 4.2 . 10{sup -5} in the vapour pressure. The critical pressure p {sub c} was treated as an adjustable parameter and the value of p {sub c} = 3027 kPa was calculated from the smoothing equation using a selected critical temperature of T {sub c} = 507.49 K. The calculated normal boiling temperature is T {sub b} 341.866 K and an extrapolation to the triple-point temperature T {sub tp} 177.87 K predicts a triple-point pressure of p {sub tp} = 1.23 Pa.

  9. Methyldichloroborane evidenced as an intermediate in the chemical vapour deposition synthesis of boron carbide.

    Science.gov (United States)

    Reinisch, G; Patel, S; Chollon, G; Leyssale, J-M; Alotta, D; Bertrand, N; Vignoles, G L

    2011-09-01

    The most recent ceramic-matrix composites (CMC) considered for long-life applications as thermostructural parts in aerospace propulsion contain, among others, boron-rich phases like boron carbide. This compound is prepared by thermal Chemical Vapour Infiltration (CVI), starting from precursors like boron halides and hydrocarbons. We present a study aiming at a precise knowledge of the gas-phase composition in a hot-zone LPCVD reactor fed with BCl3, CH4 and H2, which combines experimental and theoretical approaches. This work has brought strong evidences of the presence of Methydichloroborane (MDB, BCl2CH3) in the process. It is demonstrated that this intermediate, the presence of which had never been formally proved before, appears for processing temperatures slightly lower than the deposition temperature of boron carbide. The study features quantum chemical computations, which provide several pieces of information like thermochemical and kinetic data, as well as vibration and rotation frequencies, reaction kinetics computations, and experimental gas-phase characterization of several species by FTIR, for several processing parameter sets. The main results are presented, and the place of MDB in the reaction scheme is discussed.

  10. Single liquid-source plasma enhanced metalorganic chemical vapor deposition of YBa sub 2 Cu sub 3 O sub 7-x thin films. Technical report

    Energy Technology Data Exchange (ETDEWEB)

    Zhang, J.; Gardiner, R.; Kirlin, P.S.; Boerstler, R.W.; Steinbeck, J.

    1992-07-29

    High quality YBa2Cu3O7-x films were grown in-situ on LaAlO3 (100) by a novel single liquid source plasma-enhanced metalorganic chemical vapor deposition process. The metalorganic complexes M(thd)n, (thd = 2,2,6,6-tetramethyl-3,5-heptanedionate; M = Y, Ba, Cu) were dissolved in an organic solution and injected into a vaporizer immediately upstream of the reactor inlet The single liquid source technique dramatically simplifies current CVD processing and can significantly improve the process reproducibility. X-ray diffraction. measurements indicated that single phase, highly c-axis oriented YBa2Cu3O7-x was formed in-situ at a substrate temperature 680 degC. The as-deposited films exhibited a mirror-like surface, had transition temperature Tc = 89 K, Delta Tc < 1K, and Jc(77K) = 106 A/cm2. Plasma enhanced metalorganic chemical vapor deposition, YBCO, superconductors.

  11. Ethanol vapour sensing properties of screen printed WO3 thick films

    Indian Academy of Sciences (India)

    This paper presents ethanol vapour sensing properties of WO3 thick films. In this work, the WO3 thick films were prepared by standard screen-printing method. These films were characterized by X-ray diffraction (XRD) measurements and scanning electron microscopy (SEM). The ethanol vapour sensing properties of these ...

  12. Ethanol vapour sensing properties of screen printed WO3 thick films

    Indian Academy of Sciences (India)

    TECS

    Abstract. This paper presents ethanol vapour sensing properties of WO3 thick films. In this work, the WO3 thick films were prepared by standard screen-printing method. These films were characterized by X-ray diffraction (XRD) measurements and scanning electron microscopy (SEM). The ethanol vapour sensing pro-.

  13. Methods for estimating the vapour pressure of organic chemicals; Application to five pesticides

    NARCIS (Netherlands)

    Leistra, M.

    2011-01-01

    When studying and modelling the volatilisation of pesticides from crops, their vapour pressure is an essential property. In the critical evaluation of vapour pressures stated by various sources, problems were encountered. Therefore, an inventory was made of readily-usable methods for estimating

  14. Utility of DMSP-SSM/I for integrated water vapour over the Indian seas

    Indian Academy of Sciences (India)

    R. Narasimhan (Krishtel eMaging Solutions)

    Recent algorithms for Special Sensor Microwave/Imager (DMSP-SSM/I) satellite data are used for estimating integrated water vapour over the Indian seas. Integrated water vapour obtained from these algorithms is compared with that derived from radiosonde observations at Minicoy and Port. Blair islands. Algorithm-3 of ...

  15. New Method of Vapour Discrimination Using the Thickness Shear Mode (TSM Resonator

    Directory of Open Access Journals (Sweden)

    J. Siddiqi

    2003-06-01

    Full Text Available The Impedance analysis technique complimented with curve fitting software was used to monitor changes in film properties of Thickness Shear Mode (TSM resonator on vapour exposure. The approach demonstrates how sensor selectivity can be achieved through unique changes in film viscosity caused by organic vapour adsorption.

  16. Utility of DMSP-SSM/I for integrated water vapour over the Indian seas

    Indian Academy of Sciences (India)

    Recent algorithms for Special Sensor Microwave/Imager (DMSP-SSM/I) satellite data are used for estimating integrated water vapour over the Indian seas. Integrated water vapour obtained from these algorithms is compared with that derived from radiosonde observations at Minicoy and Port Blair islands. Algorithm-3 of ...

  17. Utility of DMSP-SSM/I for integrated water vapour over the Indian seas

    Indian Academy of Sciences (India)

    R. Narasimhan (Krishtel eMaging Solutions)

    algorithm, distribution of integrated water vapour is determined during the monsoon depression. (22nd–27th July, 1992) that formed over the Bay of Bengal. 1. Introduction. Information on large variations in atmospheric water vapour is of great importance for under- standing the development of different atmospheric.

  18. Effect of post-deposition annealing on low temperature metalorganic chemical vapor deposited gallium oxide related materials

    Science.gov (United States)

    Takiguchi, Yuki; Miyajima, Shinsuke

    2017-06-01

    Low temperature metalorganic chemical vapor deposition using trimethylgallium and water was investigated. The surface morphology of the film was almost flat at a deposition temperature below 182 °C. This flat film was a mixture of nanocrystalline and amorphous phase. The film deposited at a temperature of 272 °C resulted in a nanowire structure. X-ray diffraction measurements revealed that the nanowire film was a mixture of gallium hydroxide, gallium oxyhydroxide, and gallium tohdite or gallium oxide. We also found that post-deposition annealing above 600 °C significantly changed the crystal structure of the both flat and nanowire films. Monoclinic gallium oxide phase was dominant after the post-deposition annealing above 600 °C.

  19. Single liquid source plasma enhanced metalorganic chemical vapor deposition of YBa2Cu3O(7-x) thin films

    Science.gov (United States)

    Zhang, Jiming; Gardiner, Robin; Kirlin, Peter S.; Boerstler, Robert W.; Steinbeck, John

    1992-07-01

    High quality YBa2Cu3O(7-x) films were grown in-situ on LaAlO3 (100) by a novel single liquid source plasma-enhanced metalorganic chemical vapor deposition process. The metalorganic complexes M(thd)(sub n), (thd = 2,2,6,6-tetramethyl-3,5-heptanedionate; M = Y, Ba, Cu) were dissolved in an organic solution and injected into a vaporizer immediately upstream of the reactor inlet. The single liquid source technique dramatically simplifies current CVD processing and can significantly improve the process reproducibility. X-ray diffraction. measurements indicated that single phase, highly c-axis oriented YBa2Cu3O(7-x) was formed in-situ at a substrate temperature 680 C. The as-deposited films exhibited a mirror-like surface, had transition temperature T(sub c0) approximately equal to 89 K, Delta T(sub c) less than 1 K, and Jc (77 K) = 10(exp 6) A/sq cm.

  20. Vapour pressure of D2O - Ice at temperatures below 237 K

    International Nuclear Information System (INIS)

    Heras, J.M.; Asensio, M.C.; Estiu, G.; Viscido, L.

    1984-01-01

    Accurate measurements of heavy water ice vapour pressures between 193 and 253 K have been carried out and an equation based on thermodynamic data has been derived in order to calculate the D 2 O-ice vapour pressures between 173 and 273 K. The agreement between our calculated vapour pressures and the available experimental data including those in this paper, is very good. The comparison between the theoretical calculations of H 2 O-ice and D 2 O-ice vapour pressures confirms the experimental evidence that H 2 O-ice is more volatile than D 2 O-ice at all temperatures in agreement with the vapour isotopic effect theory (VPIE).(author)

  1. The Research on Atmospheric Pressure Water Vapour Plasma Generation and Application for the Destruction of Wastes

    Directory of Open Access Journals (Sweden)

    Viktorija Grigaitiene

    2013-01-01

    Full Text Available In the Lithuanian Energy Institute an experimental atmospheric pressure Ar/water vapour plasma torch has been designed and tested. The power of plasma torch was estimated 40 ÷ 69 kW, the mean temperature of plasma jet at the exhaust nozzle was 2300÷2900K. The chemical compositionof water vapour plasma was established from the emission spectrum lines at 300 ÷ 800nm range. The main species observed in Ar/water vapour plasma were: Ar, OH, H, O, Cu. The experiments on water vapour steam reforming were performed. The results confirmed that water vapour plasma has the unique properties – high enthalpy and environmentally friendly conditions. It could be employed for environmental purposes such as destruction of wastes into simple molecules or conversion to synthetic gas.

  2. A group contribution method for estimating the vapour pressures of α-pinene oxidation products

    Directory of Open Access Journals (Sweden)

    M. Capouet

    2006-01-01

    Full Text Available A prediction method based on group contribution principles is proposed for estimating the vapour pressure of α-pinene oxidation products. Temperature dependent contributions are provided for the following chemical groups: carbonyl, nitrate, hydroxy, hydroperoxy, acyl peroxy nitrate and carboxy. On the basis of observed vapour pressure differences between isomers of diols and dinitrates, a simple refinement is introduced in the method to account for the influence of substitutions on the vapour pressure for alcohols and nitrates. The vapour pressures predicted with this new method have been compared with the predictions from UNIFAC (Asher et al., 2002. Given the large uncertainties of the vapour pressure data for the least volatile compounds, further experimental studies of subcooled vapour pressures of multifunctional compounds at ambient temperatures are required for better parameterizations. Among the α-pinene products identified to date, pinic acid and hydroxy pinonic acid are predicted to be the least volatile compounds, with estimated vapour pressures of 3×10−6 torr and 6×10−7 torr, respectively. The vapour pressure of the other primary products range from 10−5 to 10−3 torr, with hydroxy hydroperoxides presenting the lowest values. Noting that multifunctional carboxylic acids, in particular pinic acid, are believed to be mostly present as dimers in laboratory conditions, we suggest that the partial vapour pressure of the pinic acid dimer should be close to the experimental subcooled vapour pressure for pinic acid (estimated at ~10−6 torr due to its large contribution to the total concentration (dimer+monomer in experimental conditions.

  3. A group contribution method for estimating the vapour pressures of α-pinene oxidation products

    Science.gov (United States)

    Capouet, M.; Müller, J.-F.

    2006-05-01

    A prediction method based on group contribution principles is proposed for estimating the vapour pressure of α-pinene oxidation products. Temperature dependent contributions are provided for the following chemical groups: carbonyl, nitrate, hydroxy, hydroperoxy, acyl peroxy nitrate and carboxy. On the basis of observed vapour pressure differences between isomers of diols and dinitrates, a simple refinement is introduced in the method to account for the influence of substitutions on the vapour pressure for alcohols and nitrates. The vapour pressures predicted with this new method have been compared with the predictions from UNIFAC (Asher et al., 2002). Given the large uncertainties of the vapour pressure data for the least volatile compounds, further experimental studies of subcooled vapour pressures of multifunctional compounds at ambient temperatures are required for better parameterizations. Among the α-pinene products identified to date, pinic acid and hydroxy pinonic acid are predicted to be the least volatile compounds, with estimated vapour pressures of 3×10-6 torr and 6×10-7 torr, respectively. The vapour pressure of the other primary products range from 10-5 to 10-3 torr, with hydroxy hydroperoxides presenting the lowest values. Noting that multifunctional carboxylic acids, in particular pinic acid, are believed to be mostly present as dimers in laboratory conditions, we suggest that the partial vapour pressure of the pinic acid dimer should be close to the experimental subcooled vapour pressure for pinic acid (estimated at ~10-6 torr) due to its large contribution to the total concentration (dimer+monomer) in experimental conditions.

  4. Chemical vapour deposition synthetic diamond: materials, technology and applications

    International Nuclear Information System (INIS)

    Balmer, R S; Brandon, J R; Clewes, S L; Dhillon, H K; Dodson, J M; Friel, I; Inglis, P N; Madgwick, T D; Markham, M L; Mollart, T P; Perkins, N; Scarsbrook, G A; Twitchen, D J; Whitehead, A J; Wilman, J J; Woollard, S M

    2009-01-01

    Substantial developments have been achieved in the synthesis of chemical vapour deposition (CVD) diamond in recent years, providing engineers and designers with access to a large range of new diamond materials. CVD diamond has a number of outstanding material properties that can enable exceptional performance in applications as diverse as medical diagnostics, water treatment, radiation detection, high power electronics, consumer audio, magnetometry and novel lasers. Often the material is synthesized in planar form; however, non-planar geometries are also possible and enable a number of key applications. This paper reviews the material properties and characteristics of single crystal and polycrystalline CVD diamond, and how these can be utilized, focusing particularly on optics, electronics and electrochemistry. It also summarizes how CVD diamond can be tailored for specific applications, on the basis of the ability to synthesize a consistent and engineered high performance product.

  5. Solvation model for estimating the properties of (vapour + liquid) equilibrium

    International Nuclear Information System (INIS)

    Senol, Aynur

    2008-01-01

    A solvation energy relation (SERAS) has been developed for correlating the properties and (vapour + liquid) equilibrium (VLE) of associated systems capable of hydrogen bonding or dipole-dipole interaction. The model clarifies the simultaneous impact of hydrogen bonding, solubility and thermodynamic factors of activity coefficients derived from the UNIFAC-original model. The consistency test has been processed against binary VLE data for six isobaric systems of hydrogen bonding (I to III) and dipole-dipole interaction (IV to VI) types, and two isothermal systems of both types (VII and VIII). Systems II, III, and VIII show negative non-ideal deviations. The reliability analysis has been conducted on the performance of the SERAS model with 5- and 10-parameters. The model matches relatively well with the observed performance, yielding mean error of 9.7% for all the systems and properties considered

  6. Solvation model for estimating the properties of (vapour + liquid) equilibrium

    Energy Technology Data Exchange (ETDEWEB)

    Senol, Aynur [Istanbul University, Faculty of Engineering, Department of Chemical Engineering, 34320 Avcilar, Istanbul (Turkey)], E-mail: senol@istanbul.ed.tr

    2008-08-15

    A solvation energy relation (SERAS) has been developed for correlating the properties and (vapour + liquid) equilibrium (VLE) of associated systems capable of hydrogen bonding or dipole-dipole interaction. The model clarifies the simultaneous impact of hydrogen bonding, solubility and thermodynamic factors of activity coefficients derived from the UNIFAC-original model. The consistency test has been processed against binary VLE data for six isobaric systems of hydrogen bonding (I to III) and dipole-dipole interaction (IV to VI) types, and two isothermal systems of both types (VII and VIII). Systems II, III, and VIII show negative non-ideal deviations. The reliability analysis has been conducted on the performance of the SERAS model with 5- and 10-parameters. The model matches relatively well with the observed performance, yielding mean error of 9.7% for all the systems and properties considered.

  7. Thermoluminescence characterisation of chemical vapour deposited diamond films

    CERN Document Server

    Mazzocchi, S; Bucciolini, M; Cuttone, G; Pini, S; Sabini, M G; Sciortino, S

    2002-01-01

    The thermoluminescence (TL) characteristics of a set of six chemical vapour deposited diamond films have been studied with regard to their use as off-line dosimeters in radiotherapy. The structural characterisation has been performed by means of Raman spectroscopy. Their TL responses have been tested with radiotherapy beams ( sup 6 sup 0 Co photons, photons and electrons from a linear accelerator (Linac), 26 MeV protons from a TANDEM accelerator) in the dose range 0.1-7 Gy. The dosimetric characterisation has yielded a very good reproducibility, a very low dependence of the TL response on the type of particle and independence of the radiation energy. The TL signal is not influenced by the dose rate and exhibits a very low thermal fading. Moreover, the sensitivity of the diamond samples compares favourably with that of standard TLD100 dosimeters.

  8. Resonances of coherent population trapping in samarium vapours

    International Nuclear Information System (INIS)

    Kolachevsky, Nikolai N; Akimov, A V; Kiselev, N A; Papchenko, A A; Sorokin, Vadim N; Kanorskii, S I

    2001-01-01

    Resonances of coherent population trapping were detected in atomic vapours of the rare-earth element samarium. The coherent population trapping was produced by two external-cavity diode lasers (672 and 686 nm) in a Λ-system formed by the three levels of 154 Sm: the 4f 6 6s 2 ( 7 F 0 ) ground state, the first fine-structure 4f 6 6s 2 ( 7 F 1 ) sublevel of the ground state and the 4f 6 ( 7 F)6s6p( 3 P o ) 9 F o 1 upper level. The dependence of the spectral shapes and resonance contrasts on the polarisation of the laser beams and the direction of the applied magnetic field was studied. The obtained results were analysed. (nonlinear optical phenomena)

  9. Comparative study of vapour compression, thermoelectric and absorption refrigerators

    Energy Technology Data Exchange (ETDEWEB)

    Bansal, P.K.; Martin, A. [Auckland Univ., Dept. of Mechanical Engineering, Auckland (New Zealand)

    2000-07-01

    This paper investigates the performance characteristics of the three domestic refrigerators, namely the vapour compression (VC), the thermoelectric (TE) and the absorption refrigeration (AR). AR and TE refrigerators are the result of research and development in refrigeration systems in the quest to find a cooling system which does not use any refrigerant that damages the ozone layer. Three refrigerators of similar capacity (about 50l) were compared for their usage in the hotel industry in view of their energy efficiency, noise produced and cost (owning as well as running). It was found that the VC refrigerator consumed the least energy, was least costly but was the noisiest. The absorption refrigerator was the quietest of the three but was the least energy efficient and most expensive. The thermoelectric refrigerator was the costliest, nearly as noisy as the VC but was a little less energy efficient than the absorption refrigerator. (Author)

  10. Polarized Raman spectroscopy of chemically vapour deposited diamond films

    International Nuclear Information System (INIS)

    Prawer, S.; Nugent, K.W.; Weiser, P.S.

    1994-01-01

    Polarized micro-Raman spectra of chemically vapour deposited diamond films are presented. It is shown that important parameters often extracted from the Raman spectra such as the ratio of the diamond to non-diamond component of the films and the estimation of the level of residual stress depend on the orientation of the diamond crystallites with respect to the polarization of the incident laser beam. The dependence originates from the fact that the Raman scattering from the non-diamond components in the films is almost completely depolarized whilst the scattering from the diamond components is strongly polarized. The results demonstrate the importance of taking polarization into account when attempting to use Raman spectroscopy in even a semi-quantitative fashion for the assessment of the purity, perfection and stress in CVD diamond films. 8 refs., 1 tab. 2 figs

  11. Plasma Enhanced Chemical Vapour Deposition of Horizontally Aligned Carbon Nanotubes

    Directory of Open Access Journals (Sweden)

    Matthew T. Cole

    2013-05-01

    Full Text Available A plasma-enhanced chemical vapour deposition reactor has been developed to synthesis horizontally aligned carbon nanotubes. The width of the aligning sheath was modelled based on a collisionless, quasi-neutral, Child’s law ion sheath where these estimates were empirically validated by direct Langmuir probe measurements, thereby confirming the proposed reactors ability to extend the existing sheath fields by up to 7 mm. A 7 mbar growth atmosphere combined with a 25 W plasma permitted the concurrent growth and alignment of carbon nanotubes with electric fields of the order of 0.04 V μm−1 with linear packing densities of up to ~5 × 104 cm−1. These results open up the potential for multi-directional in situ alignment of carbon nanotubes providing one viable route to the fabrication of many novel optoelectronic devices.

  12. Mechanisms of distinct activated carbon and biochar amendment effects on petroleum vapour biofiltration in soil.

    Science.gov (United States)

    Bushnaf, Khaled M; Mangse, George; Meynet, Paola; Davenport, Russell J; Cirpka, Olaf A; Werner, David

    2017-10-18

    We studied the effects of two percent by weight activated carbon versus biochar amendments in 93 cm long sand columns on the biofiltration of petroleum vapours released by a non-aqueous phase liquid (NAPL) source. Activated carbon greatly enhanced, whereas biochar slightly reduced, the biofiltration of volatile petroleum hydrocarbons (VPHs) over 430 days. Sorbent amendment benefitted the VPH biofiltration by retarding breakthrough during the biodegradation lag phase. Subsequently, sorbent amendment briefly reduced the mineralization of petroleum hydrocarbons by limiting their bioavailability. During the last and longest study period, when conditions became less supportive of microbial growth, because of inorganic nutrient scarcity, the sorbents again improved the pollution attenuation by preventing the degrading microorganisms from being overloaded with VPHs. A 16S rRNA gene based analysis showed sorbent amendment effects on soil microbial communities. Nocardioidaceae benefitted the most from petroleum hydrocarbons in activated carbon amended soil, whereas Pseudomonadacea predominated in unamended soil. Whilst the degrading microorganisms were overloaded with VPHs in the unamended soil, the reduced mobility and bioavailability of VPHs in the activated carbon amended soil led to the emergence of communities with higher specific substrate affinity, which removed bioavailable VPHs effectively at low concentrations. A numerical pollutant fate model reproduced these experimental observations by considering sorption effects on the pollutant migration and bioavailability for growth of VPH degrading biomass, which is limited by a maximum soil biomass carrying capacity. Activated carbon was a much stronger sorbent for VPHs than biochar, which explained the diverging effects of the two sorbents in this study.

  13. Line-shape study of water vapour by tunable diode laser spectrometer in the 822 832 nm wavelength region

    Science.gov (United States)

    Ray, A.; Bandyopadhyay, A.; Ray, B.; Biswas, D.; Ghosh, P. N.

    2004-11-01

    A near-infrared tunable diode laser absorption spectrometer is set up to measure the air-induced broadening coefficients and the line-strength parameters of water-vapour overtone transitions within the (2,1,1)←(0,0,0) band in the 822 832 nm wavelength region. A Hitachi HL8311 E double hetero-junction structure diode laser is used as a probe. The diode laser controller is home-built and stable within ±10 μA and ±10 mK, respectively. The laser-head mount has a simple design and provides easy access whenever changing of the laser head is required. The diode laser emission wavelength is thermally tuned between 50 °C and 12 °C. Thermal tuning of the diode laser emission wavelength is used to reveal the mode structure of the diode laser and to probe the overtone-band transitions of water vapour within its operating wavelength range. Current tuning of the diode laser is used at a fixed laser temperature to study the transitions one at a time. A balanced detector is used to improve the S/N ratio of the spectrum. A phase sensitive detection technique is followed to obtain the first-derivative spectra of the overtone transitions. The first-derivative spectra have been recorded at different air pressures inside the sample cell while the water-vapour pressure is kept fixed. The first-derivative spectrum is numerically integrated to obtain the original line shape. The original line shape is fitted with a Voigt profile by using a nonlinear least-squares fit program to extract the air-broadening coefficient and the line-strength parameter. The data obtained in our work is compared with the results of the HITRAN database.

  14. Effect of sugars on liquid-vapour partition of volatile compounds in ready-to-drink coffee beverages.

    Science.gov (United States)

    Piccone, P; Lonzarich, V; Navarini, L; Fusella, G; Pittia, P

    2012-09-01

    The effect of sugars (sucrose, lactose, glucose, fructose, 10%w/v) on the liquid-vapour partition of selected volatile compounds of coffee beverages has been investigated in espresso coffee and ready-to-drink (RTD) canned coffee prepared and obtained by using the same Arabica roasted coffee beans blend. Aroma composition of coffee beverages has been preliminary investigated by headspace-gas chromatography (HS-GC) and solid phase microextraction-HS-GC-mass spectrometry to characterize the volatile pattern of the systems and to evaluate the effects of sugars on the aroma release/retention. Then, the liquid-vapour partition coefficient (k) of 4 selected key aroma compounds (diacetyl, 2,3-pentanedione, ethylpyrazine, hexanal) was determined in water, sugars solutions as well as RTD coffee brews added with the same sugars (10%w/v). Sugars added in coffee beverages affected the release of the volatiles and thus its aroma profile with differences due to the type of added sugar and coffee brew type. The k values of the selected volatile compounds resulted different depending on the model system composition (water, coffee brew) and sugar type added. In particular, melanoidins as well as other non-volatile components (lipids, acids, carbohydrates) in the RTD coffee brews could be implied in the change of k of the volatile compounds in respect to that observed in water. The effects of the sugar type on the release/retention of the four key coffee aroma compounds were partly explained in terms of 'salting out' especially for the more polar volatile compounds and in the sucrose-added model systems. The change of chemical and physico-chemical properties of the water and brews induced by the sugars as well as the occurrence of interactions between volatile compounds and non-volatile components may be implied in the reduction of the vapour partition of the aroma compounds. Copyright © 2012 John Wiley & Sons, Ltd.

  15. Water vapour retrieval using the Precision Solar Spectroradiometer

    Science.gov (United States)

    Raptis, Panagiotis-Ioannis; Kazadzis, Stelios; Gröbner, Julian; Kouremeti, Natalia; Doppler, Lionel; Becker, Ralf; Helmis, Constantinos

    2018-02-01

    The Precision Solar Spectroradiometer (PSR) is a new spectroradiometer developed at Physikalisch-Meteorologisches Observatorium Davos - World Radiation Center (PMOD-WRC), Davos, measuring direct solar irradiance at the surface, in the 300-1020 nm spectral range and at high temporal resolution. The purpose of this work is to investigate the instrument's potential to retrieve integrated water vapour (IWV) using its spectral measurements. Two different approaches were developed in order to retrieve IWV: the first one uses single-channel and wavelength measurements, following a theoretical water vapour high absorption wavelength, and the second one uses direct sun irradiance integrated at a certain spectral region. IWV results have been validated using a 2-year data set, consisting of an AERONET sun-photometer Cimel CE318, a Global Positioning System (GPS), a microwave radiometer profiler (MWP) and radiosonde retrievals recorded at Meteorological Observatorium Lindenberg, Germany. For the monochromatic approach, better agreement with retrievals from other methods and instruments was achieved using the 946 nm channel, while for the spectral approach the 934-948 nm window was used. Compared to other instruments' retrievals, the monochromatic approach leads to mean relative differences up to 3.3 % with the coefficient of determination (R2) being in the region of 0.87-0.95, while for the spectral approach mean relative differences up to 0.7 % were recorded with R2 in the region of 0.96-0.98. Uncertainties related to IWV retrieval methods were investigated and found to be less than 0.28 cm for both methods. Absolute IWV deviations of differences between PSR and other instruments were determined the range of 0.08-0.30 cm and only in extreme cases would reach up to 15 %.

  16. Mixed garnet laser crystals for water vapour DIAL transmitter

    Science.gov (United States)

    Treichel, Rainer; Czeranowsky, Christoph; Ileri, Bilge; Petermann, Klaus; Huber, Günter

    2017-11-01

    There are more or less well established technologies such as the optical-parametric-oscillator (OPO), the Raman-laser, and the Ti-Sapphire laser, which are able to emit laser light in the region of the water vapour absorption lines. For WALES the regions of about 935 nm, 942 nm, and 944 nm have been identified as the most suitable wavelength ranges. However, each of these laser designs is highly sophisticated. Current baseline for WALES is the Ti-Sapphire laser. A fourth possibility to achieve these wavelength ranges is to shift the groundstate laser lines (938 nm and 946 nm) of the Nd:YAG laser by replacing Aluminium and Yttrium by other rare earth elements. Changes of the host lattice characteristics lead to a shift of the upper and lower laser levels. These modified crystals are summarized under the name of "Mixed Garnet" crystals. Only the Mixed Garnet lasers can be pumped directly with diode laser and use a direct approach to generate the required laser pulses without frequency conversion. Therefore no additional non-linear crystals are needed and a higher electric to optical efficiency is expected as well as single frequency operation using spectral tuning elements like etalons. Such lasers have the great potential to fulfil the requirements and to become the preferred transmitter concept for WALES as well as for follow up missions. Within a ESA study several crystal compositions have been grown, spectrally characterised and analysed. Absorbed space radiation energy in the crystal lattice causes colour centres, which can reabsorb the pump and laser wavelength and consequently reduce the laser gain considerably. Co-dopants such as Chromium and Cerium are able to suppress the colour centres and are candidates for effective radiation hardening. The results of the crystal tuning, the co-doping with different radiation hardeners and the radiation tests will be presented. There applicability for a space based water vapour DIAL transmitter will be discussed.

  17. Statistical mechanics of binary mixture adsorption in metal-organic frameworks in the osmotic ensemble

    Science.gov (United States)

    Dunne, Lawrence J.; Manos, George

    2018-03-01

    Although crucial for designing separation processes little is known experimentally about multi-component adsorption isotherms in comparison with pure single components. Very few binary mixture adsorption isotherms are to be found in the literature and information about isotherms over a wide range of gas-phase composition and mechanical pressures and temperature is lacking. Here, we present a quasi-one-dimensional statistical mechanical model of binary mixture adsorption in metal-organic frameworks (MOFs) treated exactly by a transfer matrix method in the osmotic ensemble. The experimental parameter space may be very complex and investigations into multi-component mixture adsorption may be guided by theoretical insights. The approach successfully models breathing structural transitions induced by adsorption giving a good account of the shape of adsorption isotherms of CO2 and CH4 adsorption in MIL-53(Al). Binary mixture isotherms and co-adsorption-phase diagrams are also calculated and found to give a good description of the experimental trends in these properties and because of the wide model parameter range which reproduces this behaviour suggests that this is generic to MOFs. Finally, a study is made of the influence of mechanical pressure on the shape of CO2 and CH4 adsorption isotherms in MIL-53(Al). Quite modest mechanical pressures can induce significant changes to isotherm shapes in MOFs with implications for binary mixture separation processes. This article is part of the theme issue `Modern theoretical chemistry'.

  18. Experimental (vapour + liquid) equilibrium data of (methanol + water), (water + glycerol) and (methanol + glycerol) systems at atmospheric and sub-atmospheric pressures

    International Nuclear Information System (INIS)

    Soujanya, J.; Satyavathi, B.; Vittal Prasad, T.E.

    2010-01-01

    Experimental (vapour + liquid) equilibrium results for the binary systems, (methanol + water) at the local atmospheric pressure of 95.3 kPa and at sub-atmospheric pressures of (15.19, 29.38, 42.66, 56.03, and 67.38) kPa, (water + glycerol) system at pressures (14.19, 29.38, 41.54, 54.72, 63.84, and 95.3) kPa and the (methanol + glycerol) system at pressures (32.02 and 45.3) kPa were obtained over the entire composition range using a Sweitoslwasky-type ebulliometer. The relationship of the liquid composition (x 1 ) as a function of temperature (T) was found to be well represented by the Wilson model. Computed vapour phase mole fractions, activity coefficients and the measured values along with optimum Wilson parameters are presented.

  19. Metalorganic vapour epitaxial growth and infrared characterisation of InAsSb and InAs on InAs substrates

    CSIR Research Space (South Africa)

    Baisitse, TR

    2006-07-01

    Full Text Available Motivation for the research: Interest exists in III-V semiconducting materials (InAs, GaSb, InSb and related alloys) for the detection of infrared radiation; Such materials could be used as alternatives for future infrared detectors and various...

  20. Non-equilibrium surface tension of the vapour-liquid interface of active Lennard-Jones particles

    Science.gov (United States)

    Paliwal, Siddharth; Prymidis, Vasileios; Filion, Laura; Dijkstra, Marjolein

    2017-08-01

    We study a three-dimensional system of self-propelled Brownian particles interacting via the Lennard-Jones potential. Using Brownian dynamics simulations in an elongated simulation box, we investigate the steady states of vapour-liquid phase coexistence of active Lennard-Jones particles with planar interfaces. We measure the normal and tangential components of the pressure tensor along the direction perpendicular to the interface and verify mechanical equilibrium of the two coexisting phases. In addition, we determine the non-equilibrium interfacial tension by integrating the difference of the normal and tangential components of the pressure tensor and show that the surface tension as a function of strength of particle attractions is well fitted by simple power laws. Finally, we measure the interfacial stiffness using capillary wave theory and the equipartition theorem and find a simple linear relation between surface tension and interfacial stiffness with a proportionality constant characterized by an effective temperature.

  1. Soil clean up by vapour extraction: parametrical study; Depollution des sols par extraction sous pression reduite: etude de quelques parametres

    Energy Technology Data Exchange (ETDEWEB)

    Dutheil, C.

    2003-05-15

    Soil vapour extraction is a treatment process for soils polluted by volatile organic compounds. Its principle relies on the circulation of gaseous flow in soil by the application of a depression of some hundreds milli-bars. A parametrical study has been led on a soil artificially polluted by tri-chloro-ethene. It shows that the gaseous flow rate has a slight influence on pollutants extraction yield. This is due to rate limited mass transfer processes. Soil moisture plays a negative role on treatment efficiency because of the reduction of the porosity available for the gas circulation. Tests have been performed on a soil polluted by a complex mixture of organic pollutants to elaborate a methodology of technical feasibility assessment. This methodology aims at identifying and limiting risks of site rehabilitation failure. Tests results show that soil vapour extraction was inadequate to treat the soil tested in this study because of the strong affinity between a dense organic phase (grease) and chlorinated solvents. (author)

  2. Volatility of components of saturated vapours of UCl4-CsCl and UCl4-LiCl molten mixtures

    International Nuclear Information System (INIS)

    Smirnov, M.V.; Kudyakov, V.Ya.; Salyulev, A.B.; Komarov, V.E.; Posokhin, Yu.V.; Afonichkin, V.K.

    1979-01-01

    The flow method has been used for measuring the volatility of the components from UCl 4 -CsCl and UCl 4 -LiCl melted mixtures containing 2.0, 5.0, 12.0, 25.0, 33.0, 50.0, 67.0, and 83.0 mol.% of UCl 4 within the temperature ranges of 903-1188 K and 740-1200 K, respectively. The chemical composition of saturated vapours above the melted salts has been determined. The melted mixtures in question exhibit negative deviation from ideal behaviour. Made was the conclusion about the presence in a vapour phase, along with monomeric UCl 4 , LiCl, CsCl and Li 2 Cl 2 , Cs 2 Cl 2 dimers of double compounds of the MeUCl 5 most probable composition. Their absolute contribution into a total pressure above the UCl 4 -CsCl melted mixtures is considerably smaller than above the UCl 4 -LiCl mixtures

  3. Metal-Organic Nanosheets Formed via Defect-Mediated Transformation of a Hafnium Metal-Organic Framework.

    Science.gov (United States)

    Cliffe, Matthew J; Castillo-Martínez, Elizabeth; Wu, Yue; Lee, Jeongjae; Forse, Alexander C; Firth, Francesca C N; Moghadam, Peyman Z; Fairen-Jimenez, David; Gaultois, Michael W; Hill, Joshua A; Magdysyuk, Oxana V; Slater, Ben; Goodwin, Andrew L; Grey, Clare P

    2017-04-19

    We report a hafnium-containing MOF, hcp UiO-67(Hf), which is a ligand-deficient layered analogue of the face-centered cubic fcu UiO-67(Hf). hcp UiO-67 accommodates its lower ligand:metal ratio compared to fcu UiO-67 through a new structural mechanism: the formation of a condensed "double cluster" (Hf 12 O 8 (OH) 14 ), analogous to the condensation of coordination polyhedra in oxide frameworks. In oxide frameworks, variable stoichiometry can lead to more complex defect structures, e.g., crystallographic shear planes or modules with differing compositions, which can be the source of further chemical reactivity; likewise, the layered hcp UiO-67 can react further to reversibly form a two-dimensional metal-organic framework, hxl UiO-67. Both three-dimensional hcp UiO-67 and two-dimensional hxl UiO-67 can be delaminated to form metal-organic nanosheets. Delamination of hcp UiO-67 occurs through the cleavage of strong hafnium-carboxylate bonds and is effected under mild conditions, suggesting that defect-ordered MOFs could be a productive route to porous two-dimensional materials.

  4. Effects of vapour bubbles on acoustic and temperature distributions of therapeutic ultrasound

    International Nuclear Information System (INIS)

    Fan Tingbo; Zhang Dong; Zhang Zhe; Ma Yong; Gong Xiufen

    2008-01-01

    This paper describes the evolution of vapour bubbles and its effect on nonlinear ultrasound propagation and temperature rise through tissues for therapeutic ultrasound. An acoustic-thermo coupling algorithm incorporating nonlinearity, diffraction, and temperature-dependent tissue properties, is employed to describe nonlinear ultrasound propagation and thermal effect. Results demonstrate that an obvious migration of peak pressure toward transducer surface is observed while the position of peak temperature changes little in liver tissue before the generation of vapour bubbles, and that the boiling region enlarges towards the surface of transducer in axial direction but increases slowly in radial direction after the generation of vapour bubbles. (classical areas of phenomenology)

  5. The heat recovery thermal vapour-compression desalting system: a comparison with other thermal desalination processes

    Energy Technology Data Exchange (ETDEWEB)

    Darwish, M.A.; El-Dessouky, Hisham [Kuwait Univ., Coll. of Engineering and Petroleum, Safat (Kuwait)

    1996-03-01

    Technical factors affecting the choice of distillation system for desalting water are presented. In particular, the thermal vapour-compression process is compared with the predominant multi-stage flash (MSF) desalting system. It was shown that the conventional multi-effect (ME) system can produce desalted water at a lower cost than the MSF system when both are supplied with steam after its expansion in steam turbines. Mechanical or thermal vapour-compression desalting systems are more cost-effective when compared with directly boiler-operated MSF systems. Thermal analysis of the multi-effect thermo-vapour-compression system is presented with an example. (author)

  6. Prediction of clay content from water vapour sorption isotherms considering hysteresis and soil organic matter content

    DEFF Research Database (Denmark)

    Arthur, E.; Tuller, M.; Møldrup, Per

    2015-01-01

    for estimating clay content from hygroscopic water at different relative humidity (RH) levels while considering hysteresis and organic matter content. Continuous adsorption/desorption vapour sorption isotherm loops were measured for 150 differently textured soils with a state-of-the-art vapour sorption analyser...... vapour sorption, which can be measured within a shorter period of time, have recently been developed. Such models are often based on single-point measurements of water adsorption and do not account for sorption hysteresis or organic matter content. The present study introduces regression relationships...... model encompasses all 150 soils regardless of organic carbon (OC) content, the second model considers only soils with OC

  7. Metal-organic Materials (moms) For Co2 Adsorption And Methods Of Using Moms

    KAUST Repository

    Eddaoudi, Mohamed

    2015-06-11

    Embodiments of the present disclosure provide for metal-organic materials (MOMs), systems that exhibit permanent porosity and using hydrophobic MOMs to separate components in a gas, methods of separating CO.sub.2 from a gas, and the like.

  8. Metal-organic materials (MOMs) for adsorption of polarizable gases and methods of using MOMs

    Science.gov (United States)

    Zaworotko, Michael; Mohamed, Mona H.; Elsaidi, Sameh

    2017-06-14

    Embodiments of the present disclosure provide for multi-component metal-organic materials (MOMs), systems including the MOM, systems for separating components in a gas, methods of separating polarizable gases from a gas mixture, and the like.

  9. Superconducting YBa2Cu3O7 - x thin films on silver substrates by in situ plasma-enhanced metalorganic chemical vapor deposition

    Science.gov (United States)

    Zhao, J.; Li, Y. Q.; Chern, C. S.; Norris, P.; Gallois, B.; Kear, B.; Wessels, B. W.

    1991-01-01

    An in situ microwave plasma-enhanced metalorganic chemical vapor deposition process was used to fabricate highly c-axis oriented YBa2Cu3O7-x superconducting thin films on metallic Ag substrates. The films were deposited at a reduced substrate temperature of 740 °C in about 270 Pa of N2O ambient. Magnetic susceptibilities versus temperature of the as-deposited films show attainment of zero resistance of 85 K and composition of single (high Tc) phase. X-ray diffraction measurements reveal that the films deposited at 740 °C have highly preferential orientation of the crystallite c axes perpendicular to the substrate surface.

  10. Multiferroic behavior associated with an order-disorder hydrogen bonding transition in metal-organic frameworks (MOFs) with the perovskite ABX3 architecture.

    Science.gov (United States)

    Jain, Prashant; Ramachandran, Vasanth; Clark, Ronald J; Zhou, Hai Dong; Toby, Brian H; Dalal, Naresh S; Kroto, Harold W; Cheetham, Anthony K

    2009-09-30

    Multiferroic behavior in perovskite-related metal-organic frameworks of general formula [(CH(3))(2)NH(2)]M(HCOO)(3), where M = Mn, Fe, Co, and Ni, is reported. All four compounds exhibit paraelectric-antiferroelectric phase transition behavior in the temperature range 160-185 K (Mn: 185 K, Fe: 160 K; Co: 165 K; Ni: 180 K); this is associated with an order-disorder transition involving the hydrogen bonded dimethylammonium cations. On further cooling, the compounds become canted weak ferromagnets below 40 K. This research opens up a new class of multiferroics in which the electrical ordering is achieved by means of hydrogen bonding.

  11. Influence of collisional rate coefficients on water vapour excitation

    Science.gov (United States)

    Daniel, F.; Goicoechea, J. R.; Cernicharo, J.; Dubernet, M.-L.; Faure, A.

    2012-11-01

    Context. Water is a key molecule in many astrophysical studies that deal with star or planet forming regions, evolved stars, and galaxies. Its high dipole moment makes this molecule subthermally populated under the typical conditions of most astrophysical objects. This motivated calculation of various sets of collisional rate coefficients (CRC) for H2O (with He or H2), which are needed to model its rotational excitation and line emission. Aims: The most accurate set of CRC are the quantum rates that involve H2. However, they have been published only recently, and less accurate CRC (quantum with He or quantum classical trajectory (QCT) with H2) were used in many studies before that. This work aims to underline the impact that the new available set of CRC have on interpretations of water vapour observations. Methods: We performed accurate non-local, non-LTE radiative transfer calculations using different sets of CRC to predict the line intensities from transitions that involve the lowest energy levels of H2O (E work, we find that the intensities based on the quantum and QCT CRC are in good agreement. However, at relatively low H2 volume density (n(H2) < 107 cm-3) and low water abundance (χ(H2O) < 10-6), which corresponds to physical conditions relevant when describing most molecular clouds, we find differences in the predicted line intensities of up to a factor of ~3 for the bulk of the lines. Most of the recent studies interpreting early Herschel Space Observatory spectra have used the QCT CRC. Our results show that, although the global conclusions from those studies will not be drastically changed, each case has to be considered individually, since depending on the physical conditions, the use of the QCT CRC may lead to a mis-estimate of the water vapour abundance of up to a factor of ~3. Additionally, the comparison of the quantum state-to-state and thermalised CRC, including the description of the population of the H2 rotational levels, show that above TK ~ 100

  12. All-sky homogeneity of precipitable water vapour over Paranal

    Science.gov (United States)

    Querel, Richard R.; Kerber, Florian

    2014-08-01

    A Low Humidity and Temperature Profiling (LHATPRO) microwave radiometer, manufactured by Radiometer Physics GmbH (RPG), is used to monitor sky conditions over ESO's Paranal observatory in support of VLT science operations. The unit measures several channels across the strong water vapour emission line at 183 GHz, necessary for resolving the low levels of precipitable water vapour (PWV) that are prevalent on Paranal (median ~2.4 mm). The instrument consists of a humidity profiler (183-191 GHz), a temperature profiler (51-58 GHz), and an infrared camera (~10 μm) for cloud detection. We present, for the first time, a statistical analysis of the homogeneity of all-sky PWV using 21 months of periodic (every 6 hours) all-sky scans from the radiometer. These data provide unique insight into the spatial and temporal variation of atmospheric conditions relevant for astronomical observations, particularly in the infrared. We find the PWV over Paranal to be remarkably homogeneous across the sky down to 27.5° elevation with a median variation of 0.32 mm (peak to valley) or 0.07 mm (rms). The homogeneity is a function of the absolute PWV but the relative variation is fairly constant at 10-15% (peak to valley) and 3% (rms). Such variations will not be a significant issue for analysis of astronomical data. Users at ESO can specify PWV - measured at zenith - as an ambient constraint in service mode to enable, for instance, very demanding observations in the infrared that can only be conducted during periods of very good atmospheric transmission and hence low PWV. We conclude that in general it will not be necessary to add another observing constraint for PWV homogeneity to ensure integrity of observations. For demanding observations requiring very low PWV, where the relative variation is higher, the optimum support could be provided by observing with the LHATPRO in the same line-of-sight simultaneously. Such a mode of operations has already been tested but will have to be

  13. A Review of Metalorganic Chemical Vapor Deposition of High-Temperature Superconducting Thin Films

    Science.gov (United States)

    Erbil, Ahmet; Zhang, K.; Kwak, B. S.; Boyd, E. P.

    1990-03-01

    A status report is given on the metalorganic chemical vapor deposition (MOCVD) of high-temperature superconducting thin films. The advantages of MOCVD processing manifest themselves in the quality of the films produced, and in the economy of the process. Metalorganic precursor requirements, deposition parameters and film properties are discussed. Also difficulties have been identified in making MOCVD a manufacturing technology. To solve these problems, future research directions are proposed.

  14. Solvent exchange in a metal-organic framework single crystal monitored by dynamic in situ X-ray diffraction.

    Science.gov (United States)

    Cox, Jordan M; Walton, Ian M; Bateman, Gage; Benson, Cassidy A; Mitchell, Travis; Sylvester, Eric; Chen, Yu Sheng; Benedict, Jason B

    2017-08-01

    Understanding the processes by which porous solid-state materials adsorb and release guest molecules would represent a significant step towards developing rational design principles for functional porous materials. To elucidate the process of liquid exchange in these materials, dynamic in situ X-ray diffraction techniques have been developed which utilize liquid-phase chemical stimuli. Using these time-resolved diffraction techniques, the ethanol solvation process in a flexible metal-organic framework [Co(AIP)(bpy) 0.5 (H 2 O)]·2H 2 O was examined. The measurements provide important insight into the nature of the chemical transformation in this system including the presence of a previously unreported neat ethanol solvate structure.

  15. Prediction of vapour-liquid and vapour-liquid-liquid equilibria of nitrogen-hydrocarbon mixtures used in J-T refrigerators

    Science.gov (United States)

    Narayanan, Vineed; Venkatarathnam, G.

    2018-03-01

    Nitrogen-hydrocarbon mixtures are widely used as refrigerants in J-T refrigerators operating with mixtures, as well as in natural gas liquefiers. The Peng-Robinson equation of state has traditionally been used to simulate the above cryogenic process. Multi parameter Helmholtz energy equations are now preferred for determining the properties of natural gas. They have, however, been used only to predict vapour-liquid equilibria, and not vapour-liquid-liquid equilibria that can occur in mixtures used in cryogenic mixed refrigerant processes. In this paper the vapour-liquid equilibrium of binary mixtures of nitrogen-methane, nitrogen-ethane, nitrogen-propane, nitrogen-isobutane and three component mixtures of nitrogen-methane-ethane and nitrogen-methane-propane have been studied with the Peng-Robinson and the Helmholtz energy equations of state of NIST REFPROP and compared with experimental data available in the literature.

  16. Enhanced Structural Support of Metal Sites as Nodes in Metal-Organic Frameworks Compared to Metal Complexes

    OpenAIRE

    Das, Sanjit

    2013-01-01

    Metal-organic frameworks are a new class of crystalline, porous solid-state materials with metal ions periodically linked by organic linkers. This gives rise to one-, two- or three-dimensional structures. Here, we compare the stability of similar metal sites toward external ligand (solvent) induced disruption of the coordination environment in metal complexes and in metal-organic frameworks. Our experimental results show that a metal site as node of a metal-organic framework retains much high...

  17. Nanostructured silicon carbon thin films grown by plasma enhanced chemical vapour deposition technique

    Energy Technology Data Exchange (ETDEWEB)

    Coscia, U. [Dipartimento di Fisica, Università di Napoli “Federico II” Complesso Universitario MSA, via Cinthia, 80126 Napoli (Italy); CNISM Unita' di Napoli, Complesso Universitario MSA, via Cinthia, 80126 Napoli (Italy); Ambrosone, G., E-mail: ambrosone@na.infn.it [Dipartimento di Fisica, Università di Napoli “Federico II” Complesso Universitario MSA, via Cinthia, 80126 Napoli (Italy); SPIN-CNR, Complesso Universitario MSA, via Cinthia, 80126 Napoli (Italy); Basa, D.K. [Department of Physics, Utkal University, Bhubaneswar 751004 (India); Rigato, V. [INFN Laboratori Nazionali Legnaro, 35020 Legnaro (Padova) (Italy); Ferrero, S.; Virga, A. [Dipartimento di Scienza Applicata e Tecnologia, Politecnico di Torino, C.so Duca degli Abruzzi 24, 10129 Torino (Italy)

    2013-09-30

    Nanostructured silicon carbon thin films, composed of Si nanocrystallites embedded in hydrogenated amorphous silicon carbon matrix, have been prepared by varying rf power in ultra high vacuum plasma enhanced chemical vapour deposition system using silane and methane gas mixtures diluted in hydrogen. In this paper we have studied the compositional, structural and electrical properties of these films as a function of rf power. It is shown that with increasing rf power the atomic densities of carbon and hydrogen increase while the atomic density of silicon decreases, resulting in a reduction in the mass density. Further, it is demonstrated that carbon is incorporated into amorphous matrix and it is mainly bonded to silicon. The study has also revealed that the crystalline volume fraction decreases with increase in rf power and that the films deposited with low rf power have a size distribution of large and small crystallites while the films deposited with relatively high power have only small crystallites. Finally, the enhanced transport properties of the nanostructured silicon carbon films, as compared to amorphous counterpart, have been attributed to the presence of Si nanocrystallites. - Highlights: • The mass density of silicon carbon films decreases from 2.3 to 2 g/cm{sup 3}. • Carbon is incorporated in the amorphous phase and it is mainly bonded to silicon. • Nanostructured silicon carbon films are deposited at rf power > 40 W. • Si nanocrystallites in amorphous silicon carbon enhance the electrical properties.

  18. Comparative investigation of thermoelectric air-conditioners versus vapour compression and absorption air-conditioners

    International Nuclear Information System (INIS)

    Riffat, S.B.; Qiu Guoquan

    2004-01-01

    This paper compares the performance of three types of domestic air-conditioners, namely the vapour compression air-conditioner (VCAC), the absorption air-conditioner (AAC) and the thermoelectric air-conditioner (TEAC). The basic cycles of the three types of air-conditioning systems are described and methods to calculate their coefficients of performance are presented. General specification data for each type of air-conditioner are given, and performance characteristics are presented. The comparison shows that although VCACs have the advantages of high COP and low purchase price, use of these systems will be phased out due to their contribution to the greenhouse effect and depletion of the ozone layer. AACs are generally bulky, complex and expensive but operate on thermal energy, so their operational consumption is low. TEACs are environmental friendly, simple and reliable but still very expensive at present. Their low COP is an additional factor limiting their application for domestic cooling. TEACs however, have a large potential market as air-conditioners for small enclosures, such as cars and submarine cabins, where the power consumption would be low, or safety and reliability would be important

  19. Atmospheric pressure chemical vapour deposition of boron doped titanium dioxide for photocatalytic water reduction and oxidation.

    Science.gov (United States)

    Carmichael, Penelope; Hazafy, David; Bhachu, Davinder S; Mills, Andrew; Darr, Jawwad A; Parkin, Ivan P

    2013-10-21

    Boron-doped titanium dioxide (B-TiO2) films were deposited by atmospheric pressure chemical vapour deposition of titanium(iv) chloride, ethyl acetate and tri-isopropyl borate on steel and fluorine-doped-tin oxide substrates at 500, 550 and 600 °C, respectively. The films were characterised using powder X-ray diffraction (PXRD), which showed anatase phase TiO2 at lower deposition temperatures (500 and 550 °C) and rutile at higher deposition temperatures (600 °C). X-ray photoelectron spectroscopy (XPS) showed a dopant level of 0.9 at% B in an O-substitutional position. The ability of the films to reduce water was tested in a sacrificial system using 365 nm UV light with an irradiance of 2 mW cm(-2). Hydrogen production rates of B-TiO2 at 24 μL cm(-2) h(-1) far exceeded undoped TiO2 at 2.6 μL cm(-2) h(-1). The B-TiO2 samples were also shown to be active for water oxidation in a sacrificial solution. Photocurrent density tests also revealed that B-doped samples performed better, with an earlier onset of photocurrent.

  20. A fresh look at the thermodynamic consistency of vapour-liquid equilibria data

    International Nuclear Information System (INIS)

    Wisniak, Jaime; Ortega, Juan; Fernández, Luis

    2017-01-01

    Highlights: • The thermodynamic consistency tests commonly used to evaluate VLE data are presented and discussed. • Advantages/disadvantages for each one of test are listed using actual examples. • All manuscripts should include information about VLE variables and test results. • In any case, the Herington test should not be used for VLE data evaluation. • Simultaneous application of several tests is recommended. - Abstract: Design of a separation unit requires real information about the phase equilibrium of the system being handled. Accurate equilibrium data allows the best design from a thermodynamic viewpoint and contributes to a better knowledge about the behaviour of fluids and their mixtures. The principles behind the concept of thermodynamic consistency are presented and discussed. The present state of the art shows that no definite test is available for insuring the quality of the measured values. The main available procedures for testing the consistency of vapour-liquid equilibrium (VLE) data at constant temperature or pressure are reviewed and analysed and recommendations provided for their proper use, for the presentation of VLE results, and also some possible means for determining their quality. Suitable examples are provided about the adequate use of the available tests and about their misuse.

  1. The precise measurement of the (vapour + liquid) equilibrium properties for (CO2 + isobutane) binary mixtures

    International Nuclear Information System (INIS)

    Nagata, Y.; Mizutani, K.; Miyamoto, H.

    2011-01-01

    Recently, it has been suggested that natural working fluids, such as CO 2 , hydrocarbons, and their mixtures, could provide a long-term alternative to fluorocarbon refrigerants. (Vapour + liquid) equilibrium (VLE) data for these fluids are essential for the development of equations of state, and for industrial process such as separation and refinement. However, there are large inconsistencies among the available literature data for (CO 2 + isobutane) binary mixtures, and therefore provision of reliable and new measurements with expanded uncertainties is required. In this study, we determined precise VLE data using a new re-circulating type apparatus, which was mainly designed by Akico Co., Japan. An equilibrium cell with an inner volume of about 380 cm 3 and two optical windows was used to observe the phase behaviour. The cell had re-circulating loops and expansion loops that were immersed in a thermostatted liquid bath and air bath, respectively. After establishment of a steady state in these loops, the compositions of the samples were measured by a gas chromatograph (GL Science, GC-3200). The VLE data were measured for CO 2 /propane and CO 2 /isobutane binary mixtures within the temperature range from 300 K to 330 K and at pressures up to 7 MPa. These data were compared with the available literature data and with values predicted by thermodynamic property models.

  2. Nano sized bismuth oxy chloride by metal organic chemical vapour deposition

    Energy Technology Data Exchange (ETDEWEB)

    Jagdale, Pravin, E-mail: pravin.jagdale@polito.it [Department of Applied Science and Technology (DISAT), Politecnico di Torino, 10129 (Italy); Castellino, Micaela [Center for Space Human Robotics, Istituto Italiano di Tecnologia, Corso Trento 21, 10129 Torino (Italy); Marrec, Françoise [Laboratory of Condensed Matter Physics, University of Picardie Jules Verne (UPJV), Amiens 80039 (France); Rodil, Sandra E. [Instituto de Investigaciones en Materiales, Universidad Nacional Autonoma de Mexicom (UNAM), Mexico D.F. 04510 (Mexico); Tagliaferro, Alberto [Department of Applied Science and Technology (DISAT), Politecnico di Torino, 10129 (Italy)

    2014-06-01

    Metal organic chemical vapour deposition (MOCVD) method was used to prepare thin films of bismuth based nano particles starting from bismuth salts. Nano sized bismuth oxy chloride (BiOCl) crystals were synthesized from solution containing bismuth chloride (BiCl{sub 3}) in acetone (CH{sub 3}-CO-CH{sub 3}). Self-assembly of nano sized BiOCl crystals were observed on the surface of silicon, fused silica, copper, carbon nanotubes and aluminium substrates. Various synthesis parameters and their significant impact onto the formation of self-assembled nano-crystalline BiOCl were investigated. BiOCl nano particles were characterized by X-ray diffraction, X-ray photoelectron spectroscopy, field emission scanning electron microscopy, energy-dispersive X-ray spectroscopy and Micro-Raman spectroscopy. These analyses confirm that bismuth nanometer-sized crystal structures showing a single tetragonal phase were indeed bismuth oxy chloride (BiOCl) square platelets 18–250 nm thick and a few micrometres wide.

  3. Nano sized bismuth oxy chloride by metal organic chemical vapour deposition

    International Nuclear Information System (INIS)

    Jagdale, Pravin; Castellino, Micaela; Marrec, Françoise; Rodil, Sandra E.; Tagliaferro, Alberto

    2014-01-01

    Metal organic chemical vapour deposition (MOCVD) method was used to prepare thin films of bismuth based nano particles starting from bismuth salts. Nano sized bismuth oxy chloride (BiOCl) crystals were synthesized from solution containing bismuth chloride (BiCl 3 ) in acetone (CH 3 -CO-CH 3 ). Self-assembly of nano sized BiOCl crystals were observed on the surface of silicon, fused silica, copper, carbon nanotubes and aluminium substrates. Various synthesis parameters and their significant impact onto the formation of self-assembled nano-crystalline BiOCl were investigated. BiOCl nano particles were characterized by X-ray diffraction, X-ray photoelectron spectroscopy, field emission scanning electron microscopy, energy-dispersive X-ray spectroscopy and Micro-Raman spectroscopy. These analyses confirm that bismuth nanometer-sized crystal structures showing a single tetragonal phase were indeed bismuth oxy chloride (BiOCl) square platelets 18–250 nm thick and a few micrometres wide.

  4. Solvent-vapour-assisted pathways and the role of pre-organization in solid-state transformations of coordination polymers

    Directory of Open Access Journals (Sweden)

    James S. Wright

    2015-03-01

    Full Text Available A family of one-dimensional coordination polymers, [Ag4(O2C(CF22CF34(phenazine2(arenen]·m(arene, 1 (arene = toluene or xylene, have been synthesized and crystallographically characterized. Arene guest loss invokes structural transformations to yield a pair of polymorphic coordination polymers [Ag4(O2C(CF22CF34(phenazine2], 2a and/or 2b, with one- and two-dimensional architectures, respectively. The role of pre-organization of the polymer chains of 1 in the selectivity for formation of either polymorph is explored, and the templating effect of toluene and p-xylene over o-xylene or m-xylene in the formation of arene-containing architecture 1 is also demonstrated. The formation of arene-free phase 2b, not accessible in a phase-pure form through other means, is shown to be the sole product of loss of toluene from 1-tol·tol [Ag4(O2C(CF22CF34(phenazine2(toluene]·2(toluene, a phase containing toluene coordinated to Ag(I in an unusual μ:η1,η1 manner. Solvent-vapour-assisted conversion between the polymorphic coordination polymers and solvent-vapour influence on the conversion of coordination polymers 1 to 2a and 2b is also explored. The transformations have been examined and confirmed by X-ray diffraction, NMR spectroscopy and thermal analyses, including in situ diffraction studies of some transformations.

  5. Cooperative insertion of CO2 in diamine-appended metal-organic frameworks

    Science.gov (United States)

    McDonald, Thomas M.; Mason, Jarad A.; Kong, Xueqian; Bloch, Eric D.; Gygi, David; Dani, Alessandro; Crocellà, Valentina; Giordanino, Filippo; Odoh, Samuel O.; Drisdell, Walter S.; Vlaisavljevich, Bess; Dzubak, Allison L.; Poloni, Roberta; Schnell, Sondre K.; Planas, Nora; Lee, Kyuho; Pascal, Tod; Wan, Liwen F.; Prendergast, David; Neaton, Jeffrey B.; Smit, Berend; Kortright, Jeffrey B.; Gagliardi, Laura; Bordiga, Silvia; Reimer, Jeffrey A.; Long, Jeffrey R.

    2015-03-01

    The process of carbon capture and sequestration has been proposed as a method of mitigating the build-up of greenhouse gases in the atmosphere. If implemented, the cost of electricity generated by a fossil fuel-burning power plant would rise substantially, owing to the expense of removing CO2 from the effluent stream. There is therefore an urgent need for more efficient gas separation technologies, such as those potentially offered by advanced solid adsorbents. Here we show that diamine-appended metal-organic frameworks can behave as `phase-change' adsorbents, with unusual step-shaped CO2 adsorption isotherms that shift markedly with temperature. Results from spectroscopic, diffraction and computational studies show that the origin of the sharp adsorption step is an unprecedented cooperative process in which, above a metal-dependent threshold pressure, CO2 molecules insert into metal-amine bonds, inducing a reorganization of the amines into well-ordered chains of ammonium carbamate. As a consequence, large CO2 separation capacities can be achieved with small temperature swings, and regeneration energies appreciably lower than achievable with state-of-the-art aqueous amine solutions become feasible. The results provide a mechanistic framework for designing highly efficient adsorbents for removing CO2 from various gas mixtures, and yield insights into the conservation of Mg2+ within the ribulose-1,5-bisphosphate carboxylase/oxygenase family of enzymes.

  6. Synthesis of a Water-soluble Metal-Organic Complex Array.

    Science.gov (United States)

    Bose, Purnandhu; Sukul, Pradip K; Yaghi, Omar M; Tashiro, Kentaro

    2016-10-08

    We demonstrate a method for the synthesis of a water-soluble multimetallic peptidic array containing a predetermined sequence of metal centers such as Ru(II), Pt(II), and Rh(III). The compound, named as a water-soluble metal-organic complex array (WSMOCA), is obtained through 1) the conventional solution-chemistry-based preparation of the corresponding metal complex monomers having a 9-fluorenylmethyloxycarbonyl (Fmoc)-protected amino acid moiety and 2) their sequential coupling together with other water-soluble organic building units on the surface-functionalized polymeric resin by following the procedures originally developed for the solid-phase synthesis of polypeptides, with proper modifications. Traces of reactions determined by mass spectrometric analysis at the representative coupling steps in stage 2 confirm the selective construction of a predetermined sequence of metal centers along with the peptide backbone. The WSMOCA cleaved from the resin at the end of stage 2 has a certain level of solubility in aqueous media dependent on the pH value and/or salt content, which is useful for the purification of the compound.

  7. Metal-organic framework polymethyl methacrylate composites for open-tubular capillary electrochromatography.

    Science.gov (United States)

    Li, Li-Man; Yang, Fang; Wang, He-Fang; Yan, Xiu-Ping

    2013-11-05

    Metal-organic frameworks (MOFs) are attractive as novel separation medium due to their distinguished properties including large surface area, accessible tunnels and diverse structures. Here, we report the incorporation of MOF CAU-1 (CAU=Christian-Albrechts-University) into polymethyl methacrylate (PMMA) to produce a new composite (CAU-1@PMMA), and the fabrication of CAU-1@PMMA coated capillary for open tubular capillary electrochromatography (CEC). CAU-1 contains unprecedented [Al8(OH)4(OCH3)8](12+) clusters connected by twelve aminoterephthalic acid linkers, and is highly porous and stable in a variety of buffer solutions. The incorporation of CAU-1 into PMMA not only increases surface area, but also electroosmotic flow (EOF). As a result, the CAU-1@PMMA coated capillary column gives higher column efficiency, larger column capacity, and shorter separation time for baseline separation of two groups of aromatic carboxylic acids than the PMMA coated capillary column. Besides, the incorporation of CAU-1 also improves the resolution for the CEC separation of basic sulfa drugs and structurally related peptides. The run-to-run, day-to-day and column-to-column precision for the EOF of CAU-1@PMMA coated capillary column is 0.3%, 0.4%, and 2.2% (relative standard deviation), respectively. The results show that MOFs composites are promising stationary phases for CEC applications. Copyright © 2013 Elsevier B.V. All rights reserved.

  8. Insulator-to-Proton-Conductor Transition in a Dense Metal-Organic Framework.

    Science.gov (United States)

    Tominaka, Satoshi; Coudert, François-Xavier; Dao, Thang D; Nagao, Tadaaki; Cheetham, Anthony K

    2015-05-27

    Metal-organic frameworks (MOFs) are prone to exhibit phase transitions under stimuli such as changes in pressure, temperature, or gas sorption because of their flexible and responsive structures. Here we report that a dense MOF, ((CH3)2NH2)2[Li2Zr(C2O4)4], exhibits an abrupt increase in proton conductivity from topotactic hydration (H2O/Zr = 0.5), wherein one-fourth of the Li ions are irreversibly rearranged and coordinated by water molecules. This structure further transforms into a third crystalline structure by water uptake (H2O/Zr = 4.0). The abrupt increase in conductivity is reversible and is associated with the latter reversible structure transformation. The H2O molecules coordinated to Li ions, which are formed in the first step of the transformation, are considered to be the proton source, and the absorbed water molecules, which are formed in the second step, are considered to be proton carriers.

  9. Stepwise transformation of the molecular building blocks in a porphyrin-encapsulating metal-organic material

    KAUST Repository

    Zhang, ZhenJie

    2013-04-24

    When immersed in solutions containing Cu(II) cations, the microporous metal-organic material P11 ([Cd4(BPT)4]·[Cd(C 44H36N8)(S)]·[S], BPT = biphenyl-3,4′,5-tricarboxylate) undergoes a transformation of its [Cd 2(COO)6]2- molecular building blocks (MBBs) into novel tetranuclear [Cu4X2(COO)6(S) 2] MBBs to form P11-Cu. The transformation occurs in single-crystal to single-crystal fashion, and its stepwise mechanism was studied by varying the Cd2+/Cu2+ ratio of the solution in which crystals of P11 were immersed. P11-16/1 (Cd in framework retained, Cd in encapsulated porphyrins exchanged) and other intermediate phases were thereby isolated and structurally characterized. P11-16/1 and P11-Cu retain the microporosity of P11, and the relatively larger MBBs in P11-Cu permit a 20% unit cell expansion and afford a higher surface area and a larger pore size. © 2013 American Chemical Society.

  10. Ultrafast water sensing and thermal imaging by a metal-organic framework with switchable luminescence

    Science.gov (United States)

    Chen, Ling; Ye, Jia-Wen; Wang, Hai-Ping; Pan, Mei; Yin, Shao-Yun; Wei, Zhang-Wen; Zhang, Lu-Yin; Wu, Kai; Fan, Ya-Nan; Su, Cheng-Yong

    2017-06-01

    A convenient, fast and selective water analysis method is highly desirable in industrial and detection processes. Here a robust microporous Zn-MOF (metal-organic framework, Zn(hpi2cf)(DMF)(H2O)) is assembled from a dual-emissive H2hpi2cf (5-(2-(5-fluoro-2-hydroxyphenyl)-4,5-bis(4-fluorophenyl)-1H-imidazol-1-yl)isophthalic acid) ligand that exhibits characteristic excited state intramolecular proton transfer (ESIPT). This Zn-MOF contains amphipathic micropores (manifesting an excellent example of dynamic reversible coordination behaviour. The interconversion between the hydrated and dehydrated phases can turn the ligand ESIPT process on or off, resulting in sensitive two-colour photoluminescence switching over cycles. Therefore, this Zn-MOF represents an excellent PL water-sensing material, showing a fast (on the order of seconds) and highly selective response to water on a molecular level. Furthermore, paper or in situ grown ZnO-based sensing films have been fabricated and applied in humidity sensing (RH<1%), detection of traces of water (<0.05% v/v) in various organic solvents, thermal imaging and as a thermometer.

  11. Homochiral metal-organic frameworks and their application in chromatography enantioseparations.

    Science.gov (United States)

    Peluso, Paola; Mamane, Victor; Cossu, Sergio

    2014-10-10

    The last frontier in the chiral stationary phases (CSPs) field for chromatography enantioseparations is represented by homochiral metal-organic frameworks (MOFs), a class of organic-inorganic hybrid materials built from metal-connecting nodes and organic-bridging ligands. The modular nature of these materials allows to design focused structures by combining properly metal, organic ligands and rigid polytopic spacers. Intriguingly, chiral ligands introduce molecular chirality in the MOF-network as well as homochirality in the secondary structure of materials (such as homohelicity) producing homochiral nets in a manner mimicking biopolymers (proteins, polysaccharides) which are characterized by a definite helical sense associated with the chirality of their building blocks (amino acids or sugars). Nowadays, robust and flexible materials characterized by high porosity and surface area became available by using preparative procedures typical of the so-called reticular synthesis. This review focuses on recent developments in the synthesis and applications of homochiral MOFs as supports for chromatography enantioseparations. Indeed, despite this field is in its infancy, interesting results have been produced and a critical overview of the 12 reported applications for gas chromatography (GC) and high-performance liquid chromatography (HPLC) can orient the reader approaching the field. Mechanistic aspects are shortly discussed and a view regarding future trends in this field is provided. Copyright © 2014 Elsevier B.V. All rights reserved.

  12. Quasi-1D physics in metal-organic frameworks: MIL-47(V from first principles

    Directory of Open Access Journals (Sweden)

    Danny E. P. Vanpoucke

    2014-10-01

    Full Text Available The geometric and electronic structure of the MIL-47(V metal-organic framework (MOF is investigated by using ab initio density functional theory (DFT calculations. Special focus is placed on the relation between the spin configuration and the properties of the MOF. The ground state is found to be antiferromagnetic, with an equilibrium volume of 1554.70 Å3. The transition pressure of the pressure-induced large-pore-to-narrow-pore phase transition is calculated to be 82 MPa and 124 MPa for systems with ferromagnetic and antiferromagnetic chains, respectively. For a mixed system, the transition pressure is found to be a weighted average of the ferromagnetic and antiferromagnetic transition pressures. Mapping DFT energies onto a simple-spin Hamiltonian shows both the intra- and inter-chain coupling to be antiferromagnetic, with the latter coupling constant being two orders of magnitude smaller than the former, suggesting the MIL-47(V to present quasi-1D behavior. The electronic structure of the different spin configurations is investigated and it shows that the band gap position varies strongly with the spin configuration. The valence and conduction bands show a clear V d-character. In addition, these bands are flat in directions orthogonal to VO6 chains, while showing dispersion along the the direction of the VO6 chains, similar as for other quasi-1D materials.

  13. Sintering-Resistant Single-Site Nickel Catalyst Supported by Metal-Organic Framework.

    Science.gov (United States)

    Li, Zhanyong; Schweitzer, Neil M; League, Aaron B; Bernales, Varinia; Peters, Aaron W; Getsoian, Andrew Bean; Wang, Timothy C; Miller, Jeffrey T; Vjunov, Aleksei; Fulton, John L; Lercher, Johannes A; Cramer, Christopher J; Gagliardi, Laura; Hupp, Joseph T; Farha, Omar K

    2016-02-17

    Developing supported single-site catalysts is an important goal in heterogeneous catalysis since the well-defined active sites afford opportunities for detailed mechanistic studies, thereby facilitating the design of improved catalysts. We present herein a method for installing Ni ions uniformly and precisely on the node of a Zr-based metal-organic framework (MOF), NU-1000, in high density and large quantity (denoted as Ni-AIM) using atomic layer deposition (ALD) in a MOF (AIM). Ni-AIM is demonstrated to be an efficient gas-phase hydrogenation catalyst upon activation. The structure of the active sites in Ni-AIM is proposed, revealing its single-site nature. More importantly, due to the organic linker used to construct the MOF support, the Ni ions stay isolated throughout the hydrogenation catalysis, in accord with its long-term stability. A quantum chemical characterization of the catalyst and the catalytic process complements the experimental results. With validation of computational modeling protocols, we further targeted ethylene oligomerization catalysis by Ni-AIM guided by theoretical prediction. Given the generality of the AIM methodology, this emerging class of materials should prove ripe for the discovery of new catalysts for the transformation of volatile substrates.

  14. Chemical Reactions Catalyzed by Metalloporphyrin-Based Metal-Organic Frameworks

    Directory of Open Access Journals (Sweden)

    Kelly Aparecida Dias de Freitas Castro

    2013-06-01

    Full Text Available The synthetic versatility and the potential application of metalloporphyrins (MP in different fields have aroused researchers’ interest in studying these complexes, in an attempt to mimic biological systems such as cytochrome P-450. Over the last 40 years, synthetic MPs have been mainly used as catalysts for homogeneous or heterogeneous chemical reactions. To employ them in heterogeneous catalysis, chemists have prepared new MP-based solids by immobilizing MP onto rigid inorganic supports, a strategy that affords hybrid inorganic-organic materials. More recently, materials obtained by supramolecular assembly processes and containing MPs as building blocks have been applied in a variety of areas, like gas storage, photonic devices, separation, molecular sensing, magnets, and heterogeneous catalysis, among others. These coordination polymers, known as metal-organic frameworks (MOFs, contain organic ligands or complexes connected by metal ions or clusters, which give rise to a 1-, 2- or 3-D network. These kinds of materials presents large surface areas, Brønsted or redox sites, and high porosity, all of which are desirable features in catalysts with potential use in heterogeneous phases. Building MOFs based on MP is a good way to obtain solid catalysts that offer the advantages of bioinspired systems and zeolitic materials. In this mini review, we will adopt a historical approach to present the most relevant MP-based MOFs applicable to catalytic reactions such as oxidation, reduction, insertion of functional groups, and exchange of organic functions.

  15. Vapour pressure data of {epsilon}-caprolactone, {delta}-hexalactone, and {gamma}-caprolactone

    Energy Technology Data Exchange (ETDEWEB)

    Biazus, Taline F.; Cezaro, Alana M.; Borges, Gustavo R.; Bender, Joao P.; Franceschi, Elton; Corazza, Marcos L. [Department of Food Engineering, URI, Campus de Erechim, Av. Sete de Setembro, 1621, Erechim-RS 99700-000 (Brazil); Oliveira, J. Vladimir [Department of Food Engineering, URI, Campus de Erechim, Av. Sete de Setembro, 1621, Erechim-RS 99700-000 (Brazil)], E-mail: vladimir@uricer.edu.br

    2008-03-15

    This work reports new vapour pressure data of {epsilon}-caprolactone, {delta}-hexalactone, and {gamma}-caprolactone. Vapour pressure measurements were carried out over the temperature range of (283 to 343) K using the static method with a differential pressure transducer. Degassing was performed inside the equilibrium cell by freezing and thawing the samples under moderate vacuum (about 50 kPa). For {epsilon}-caprolactone and {delta}-hexalactone vapour pressure values varied in the range of (0.045 to 0.769) kPa and (0.005 to 0.354) kPa, respectively, while for {gamma}-caprolactone a maximum value of 1.367 kPa was found. Experimental vapour pressure data were correlated by the Antoine equation with a good agreement between experiment and model.

  16. Fission product vapour - aerosol interactions in the containment: simulant fuel studies

    International Nuclear Information System (INIS)

    Beard, A.M.; Benson, C.G.; Bowsher, B.R.

    1988-12-01

    Experiments have been conducted in the Falcon facility to study the interaction of fission product vapours released from simulant fuel samples with control rod aerosols. The aerosols generated from both the control rod and fuel sample were chemically distinct and had different deposition characteristics. Extensive interaction was observed between the fission product vapours and the control rod aerosol. The two dominant mechanisms were condensation of the vapours onto the aerosol, and chemical reactions between the two components; sorption phenomena were believed to be only of secondary importance. The interaction of fission product vapours and reactor materials aerosols could have a major impact on the transport characteristics of the radioactive emission from a degrading core. (author)

  17. Using pervaporation data in the calculation of vapour permeation hollow-fibre modules for aroma recovery

    Directory of Open Access Journals (Sweden)

    C. P. Ribeiro Jr.

    2004-12-01

    Full Text Available Taking into account the close similarity between pervaporation and vapour permeation techniques, a method for employing pervaporation flux data in the modelling of vapour permeation modules is proposed. It is based on the use of fugacity gradients across the membrane, instead of concentration ones, as the driving force for mass transfer. This procedure is interesting, for instance, in the case of aroma recovery systems, for which there is much more experimental data on pervaporation available in the literature than on vapour permeation. In order to illustrate the application of this method, pervaporation experiments for an isotropic PDMS membrane were conducted with aqueous solutions of ethyl acetate (113-2474 mg/L, and the results obtained were used to enable simulation of different vapour permeation hollow-fibre modules for recovering ethyl acetate from diluted air streams.

  18. The transition time induced narrow linewidth of the electromagnetically induced transparency in caesium vapour

    International Nuclear Information System (INIS)

    Li Luming; Peng Xiang; Liu Cheng; Guo Hong; Chen Xuzong

    2004-01-01

    We observed a narrow linewidth (∼60 kHz) in a Doppler-broadened system showing electromagnetically induced transparency in caesium atomic vapour. The transition time induced reduction of the linewidth is illustrated both theoretically and experimentally

  19. Organic Vapour Sensing Properties of Area-Ordered and Size-Controlled Silicon Nanopillar

    Directory of Open Access Journals (Sweden)

    Wei Li

    2016-11-01

    Full Text Available Here, a silicon nanopillar array (Si-NPA was fabricated. It was studied as a room-temperature organic vapour sensor, and the ethanol and acetone gas sensing properties were detected with I-V curves. I-V curves show that these Si-NPA gas sensors are sensitive to ethanol and acetone organic vapours. The turn-on threshold voltage is about 0.5 V and the operating voltage is 3 V. With 1% ethanol gas vapour, the response time is 5 s, and the recovery time is 15 s. Furthermore, an evaluation of the gas sensor stability for Si-NPA was performed. The gas stability results are acceptable for practical detections. These excellent sensing characteristics can mainly be attributed to the change of the overall dielectric constant of Si-NPA caused by the physisorption of gas molecules on the pillars, and the filling of the gas vapour in the voids.

  20. Thermalisation of high energy electrons and positrons in water vapour

    Science.gov (United States)

    Munoz, A.; Blanco, F.; Limao-Vieira, P.; Thorn, P. A.; Brunger, M. J.; Buckman, S. J.; Garcia, G.

    2008-07-01

    In this study we describe a method to simulate single electron tracks of electrons in molecular gases, particularly in water vapour, from relatively high energies, where Born (Inokuti 1971) approximation is supposed to be valid, down to thermal energies paying special attention to the low energy secondary electrons which are abundantly generated along the energy degradation procedure. Experimental electron scattering cross sections (Munoz et al. 2007) and energy loss spectra (Thorn et al. 2007) have been determined, where possible, to be used as input parameters of the simulating program. These experimental data have been complemented with optical potential calculation (Blanco and Garcia 2003) providing a complete set of interaction probability functions for each type of collision which could take place in the considered energy range: elastic, ionization, electronic excitation, vibrational and rotational excitation. From the simulated track structure (Munoz et al. 2005) information about energy deposition and radiation damage at the molecular level can be derived. A similar procedure is proposed to the study of single positron tracks in gases. Due to the lack of experimental data for positron interaction with molecules, especially for those related to energy loss and excitation cross sections, some distribution probability data have been derived from those of electron scattering by introducing positron characteristics as positroniun formation. Preliminary results for argon are presented discussing also the utility of the model to biomedical applications based on positron emitters.

  1. Long distance spin communication in chemical vapour deposited graphene

    Science.gov (United States)

    Kamalakar, M. Venkata; Groenveld, Christiaan; Dankert, André; Dash, Saroj P.

    2015-04-01

    Graphene is an ideal medium for long-distance spin communication in future spintronic technologies. So far, the prospect is limited by the smaller sizes of exfoliated graphene flakes and lower spin transport properties of large-area chemical vapour-deposited (CVD) graphene. Here we demonstrate a high spintronic performance in CVD graphene on SiO2/Si substrate at room temperature. We show pure spin transport and precession over long channel lengths extending up to 16 μm with a spin lifetime of 1.2 ns and a spin diffusion length ~6 μm at room temperature. These spin parameters are up to six times higher than previous reports and highest at room temperature for any form of pristine graphene on industrial standard SiO2/Si substrates. Our detailed investigation reinforces the observed performance in CVD graphene over wafer scale and opens up new prospects for the development of lateral spin-based memory and logic applications.

  2. Water vapour and ozone profiles in the midlatitude upper troposphere

    Directory of Open Access Journals (Sweden)

    G. Vaughan

    2005-01-01

    Full Text Available We present an investigation of upper tropospheric humidity profiles measured with a standard radiosonde, the Vaisala RS80-A, and a commercial frost-point hygrometer, the Snow White. Modifications to the Snow White, to enable the mirror reflectivity and Peltier cooling current to be monitored during flight, were found to be necessary to determine when the instrument was functioning correctly; a further modification to prevent hydrometeors entering the inlet was also implemented. From 23 combined flights of an ozonesonde, radiosonde and Snow White between September 2001 and July 2002, clear agreement was found between the two humidity sensors, with a mean difference of <2% in relative humidity from 2 to 10km, and 2.2% between 10 and 13km. This agreement required a correction to the radiosonde humidity, as described by Miloshevich et al. (2001. Using this result, the dataset of 324 ozonesonde/RS80-A profiles measured from Aberystwyth between 1991 and 2002 was examined to derive statistics for the distribution of water vapour and ozone. Supersaturation with respect to ice was frequently seen at the higher levels - 24% of the time in winter between 8 and 10km. The fairly uniform distribution of relative humidity persisted to 120% in winter, but decreased rapidly above 100% in summer.

  3. Poly(methyl methacrylate) films for organic vapour sensing

    CERN Document Server

    Capan, R; Hassan, A K; Tanrisever, T

    2003-01-01

    Optical constants and fabrication parameters are investigated using surface plasmon resonance (SPR) studies on spun films of poly(methyl methacrylate) (PMMA) derivatives in contact with two different dielectric media. A value of 1.503 for the refractive index of PMMA films produced from a solution having concentration of 1 mg ml sup - sup 1 at the speed of 3000 rpm is in close agreement with the data obtained from ellipsometric measurements. The film thickness shows a power-law dependence on the spin speed but the thickness increases almost linearly with the concentration of the spreading solution. These results are in good agreement with the hydrodynamic theory for a low-viscosity and highly volatile liquid. On the basis of SPR measurements under dynamic conditions, room temperature response of PMMA films to benzene vapours is found to be fast, highly sensitive and reversible. The sensitivity of detection of toluene, ethyl benzene and m-xylene is much smaller than that of benzene.

  4. Continuous flow chemical vapour deposition of carbon nanotube sea urchins.

    Science.gov (United States)

    de La Verpilliere, Jean; Jessl, Sarah; Saeed, Khuzaimah; Ducati, Caterina; De Volder, Michael; Boies, Adam

    2018-04-17

    Hybrid structures consisting of functional materials enhanced by carbon nanotubes (CNTs) have potential for a variety of high impact applications, as shown by the impressive progress in sensing and mechanical applications enabled by CNT-enhanced materials. The hierarchical organisation of CNTs with other materials is key to the design of macroscale devices benefiting from the unique properties of individual CNTs, provided CNT density, morphology and binding with other materials are optimized. In this paper, we provide an analysis of a continuous aerosol process to create a hybrid hierarchical sea urchin structure with CNTs organized around a functional metal oxide core. We propose a new mechanism for the growth of these carbon nanotube sea urchins (CNTSU) and give new insight into their chemical composition. To corroborate the new mechanism, we examine the influence of CNT growth conditions on CNTSU morphology and demonstrate a new in-line characterisation technique to continuously monitor aerosol CNT growth during synthesis, which enables industrial-scale production optimization. Based upon the new formation mechanism we describe the first substrate-based chemical vapour deposition growth of CNTSUs which increases CNT length and improves G to D ratio, which also allows for the formation of CNTSU carpets with unique structures.

  5. Adsorption Of Water And Benzene Vapour In Mesoporous Materials

    Directory of Open Access Journals (Sweden)

    Paulina Taba

    2008-11-01

    Full Text Available Mesoporous materials have attracted the attention of many researchers due to the potential applications promised by the materials. This article discusses adsorption of water and benzene vapour in mesoporous materials (mesoporous silica: MCM-41, MCM-48 and their modification. MCM-41 and MCM-48 were synthesized hydrothermally at 100 oC using cethyltrimethylammonium chloride or dodecyltrimethylammonium bromide for MCM-41 (C16 or MCM-41 (C12 respectively and a mixture of cethyltrimethylammonium bromide and Triton X-100 for MCM-48 as templates. Their modifications were conducted by silylation of MCM-41 (C16 and MCM-48 with trimethylchloro silane (MCM16-TMCS and MCM48-TMCS and t-butyldimethylchloro silane (MCM16-TBDMCS and MCM48-TBDMCS. Results showed that MCM-41 and MCM-48 materials had hydrophobic features which were shown in the small amount of water adsorption at low P/P0. The hydrophobicity of samples used in this study decrease in the sequence: MCM-41 (C16 > MCM-48 > MCM-41 (C12. The hydrophobicity increased when MCM-41 and MCM-48 were silylated with TMCS or TBDMCS. All unsilylated MCM materials show higher affinity to benzene at low P/P0 than the silylated samples. The results of water and benzene adsorption showed that silylated samples are promising candidates as selective adsorbents for organic compounds.

  6. Vapour and air bubble collapse analysis in viscous compressible water

    Directory of Open Access Journals (Sweden)

    Gil Bazanini

    2001-01-01

    Full Text Available Numerical simulations of the collapse of bubbles (or cavities are shown, using the finite difference method, taking into account the compressibility of the liquid, expected to occur in the final stages of the collapse process. Results are compared with experimental and theoretical data for incompressible liquids, to see the influence of the compressibility of the water in the bubble collapse. Pressure fields values are calculated in an area of 800 x 800 mm, for the case of one bubble under the hypothesis of spherical symmetry. Results are shown as radius versus time curves for the collapse (to compare collapse times, and pressure curves in the plane, for pressure fields. Such calculations are new because of their general point of view, since the existing works do not take into account the existence of vapour in the bubble, neither show the pressure fields seen here. It is also expected to see the influence of the compressibility of the water in the collapse time, and in the pressure field, when comparing pressure values.

  7. Atmospheric pressure chemical vapour deposition of vanadium diselenide thin films

    Science.gov (United States)

    Boscher, Nicolas D.; Blackman, Christopher S.; Carmalt, Claire J.; Parkin, Ivan P.; Prieto, A. Garcia

    2007-05-01

    Atmospheric pressure chemical vapour deposition (APCVD) of vanadium diselenide thin films on glass substrates was achieved by reaction of [V(NMe 2) 4] and tBu 2Se. X-ray diffraction showed that the VSe 2 films were crystalline with preferential growth either along the (1 0 1) or the (1 1 0) direction. Energy-dispersive analysis by X-rays (EDAX) gave a V:Se ratio close to 1:2 for all films. The films were matt black in appearance, were adhesive, passed the Scotch tape test but could be scratched with a steel scalpel. SEM showed that the films were composed of plate-like crystallites orientated parallel to the substrate which become longer and thicker with increasing deposition temperature. Attempts to produce vanadium selenide films were also performed using tBu 2Se and two different vanadium precursors: VCl 4 and VOCl 3. Both were found to be unsuitable for producing VSe 2 from the APCVD reaction with tBu 2Se. The VSe 2 showed charge density wave transition at 110-115 K.

  8. Tungsten Deposition on Graphite using Plasma Enhanced Chemical Vapour Deposition

    International Nuclear Information System (INIS)

    Sharma, Uttam; Chauhan, Sachin S; Sharma, Jayshree; Sanyasi, A K; Ghosh, J; Choudhary, K K; Ghosh, S K

    2016-01-01

    The tokamak concept is the frontrunner for achieving controlled thermonuclear reaction on earth, an environment friendly way to solve future energy crisis. Although much progress has been made in controlling the heated fusion plasmas (temperature ∼ 150 million degrees) in tokamaks, technological issues related to plasma wall interaction topic still need focused attention. In future, reactor grade tokamak operational scenarios, the reactor wall and target plates are expected to experience a heat load of 10 MW/m 2 and even more during the unfortunate events of ELM's and disruptions. Tungsten remains a suitable choice for the wall and target plates. It can withstand high temperatures, its ductile to brittle temperature is fairly low and it has low sputtering yield and low fuel retention capabilities. However, it is difficult to machine tungsten and hence usages of tungsten coated surfaces are mostly desirable. To produce tungsten coated graphite tiles for the above-mentioned purpose, a coating reactor has been designed, developed and made operational at the SVITS, Indore. Tungsten coating on graphite has been attempted and successfully carried out by using radio frequency induced plasma enhanced chemical vapour deposition (rf -PECVD) for the first time in India. Tungsten hexa-fluoride has been used as a pre-cursor gas. Energy Dispersive X-ray spectroscopy (EDS) clearly showed the presence of tungsten coating on the graphite samples. This paper presents the details of successful operation and achievement of tungsten coating in the reactor at SVITS. (paper)

  9. Ordered macro-microporous metal-organic framework single crystals

    Science.gov (United States)

    Shen, Kui; Zhang, Lei; Chen, Xiaodong; Liu, Lingmei; Zhang, Daliang; Han, Yu; Chen, Junying; Long, Jilan; Luque, Rafael; Li, Yingwei; Chen, Banglin

    2018-01-01

    We constructed highly oriented and ordered macropores within metal-organic framework (MOF) single crystals, opening up the area of three-dimensional–ordered macro-microporous materials (that is, materials containing both macro- and micropores) in single-crystalline form. Our methodology relies on the strong shaping effects of a polystyrene nanosphere monolith template and a double-solvent–induced heterogeneous nucleation approach. This process synergistically enabled the in situ growth of MOFs within ordered voids, rendering a single crystal with oriented and ordered macro-microporous structure. The improved mass diffusion properties of such hierarchical frameworks, together with their robust single-crystalline nature, endow them with superior catalytic activity and recyclability for bulky-molecule reactions, as compared with conventional, polycrystalline hollow, and disordered macroporous ZIF-8.

  10. Enzyme-MOF (metal-organic framework) composites.

    Science.gov (United States)

    Lian, Xizhen; Fang, Yu; Joseph, Elizabeth; Wang, Qi; Li, Jialuo; Banerjee, Sayan; Lollar, Christina; Wang, Xuan; Zhou, Hong-Cai

    2017-06-06

    The ex vivo application of enzymes in various processes, especially via enzyme immobilization techniques, has been extensively studied in recent years in order to enhance the recyclability of enzymes, to minimize enzyme contamination in the product, and to explore novel horizons for enzymes in biomedical applications. Possessing remarkable amenability in structural design of the frameworks as well as almost unparalelled surface tunability, Metal-Organic Frameworks (MOFs) have been gaining popularity as candidates for enzyme immobilization platforms. Many MOF-enzyme composites have achieved unprecedented results, far outperforming free enzymes in many aspects. This review summarizes recent developments of MOF-enzyme composites with special emphasis on preparative techniques and the synergistic effects of enzymes and MOFs. The applications of MOF-enzyme composites, primarily in transferation, catalysis and sensing, are presented as well. The enhancement of enzymatic activity of the composites over free enzymes in biologically incompatible conditions is emphasized in many cases.

  11. Ordered macro-microporous metal-organic framework single crystals

    KAUST Repository

    Shen, Kui

    2018-01-16

    We constructed highly oriented and ordered macropores within metal-organic framework (MOF) single crystals, opening up the area of three-dimensional-ordered macro-microporous materials (that is, materials containing both macro- and micropores) in single-crystalline form. Our methodology relies on the strong shaping effects of a polystyrene nanosphere monolith template and a double-solvent-induced heterogeneous nucleation approach. This process synergistically enabled the in situ growth of MOFs within ordered voids, rendering a single crystal with oriented and ordered macro-microporous structure. The improved mass diffusion properties of such hierarchical frameworks, together with their robust single-crystalline nature, endow them with superior catalytic activity and recyclability for bulky-molecule reactions, as compared with conventional, polycrystalline hollow, and disordered macroporous ZIF-8.

  12. Transformation of metal-organic frameworks for molecular sieving membranes.

    Science.gov (United States)

    Li, Wanbin; Zhang, Yufan; Zhang, Congyang; Meng, Qin; Xu, Zehai; Su, Pengcheng; Li, Qingbiao; Shen, Chong; Fan, Zheng; Qin, Lei; Zhang, Guoliang

    2016-04-19

    The development of simple, versatile strategies for the synthesis of metal-organic framework (MOF)-derived membranes are of increasing scientific interest, but challenges exist in understanding suitable fabrication mechanisms. Here we report a route for the complete transformation of a series of MOF membranes and particles, based on multivalent cation substitution. Through our approach, the effective pore size can be reduced through the immobilization of metal salt residues in the cavities, and appropriate MOF crystal facets can be exposed, to achieve competitive molecular sieving capabilities. The method can also be used more generally for the synthesis of a variety of MOF membranes and particles. Importantly, we design and synthesize promising MOF membranes candidates that are hard to achieve through conventional methods. For example, our CuBTC/MIL-100 membrane exhibits 89, 171, 241 and 336 times higher H2 permeance than that of CO2, O2, N2 and CH4, respectively.

  13. Thermodynamic properties of the liquid Hg-Tl alloys determined from vapour pressure measurements

    Directory of Open Access Journals (Sweden)

    Gierlotka W.

    2002-01-01

    Full Text Available The partial vapour pressure of mercury over liquid Hg-Tl liquid solutions were determined in the temperature range from 450 to 700 K by direct vapour pressure measurements carried out with the quartz gauge. From the measured ln pHg vs. T relationships activities of mercury were determined. Using Redlich-Kister formulas logarithms of the activity coefficients were described with the following equations: From which all thermodynamic functions in the solutions can be derived.

  14. Vapour pressures and enthalpies of vaporization of a series of the ferrocene derivatives

    International Nuclear Information System (INIS)

    Emel'yanenko, Vladimir N.; Verevkin, Sergey P.; Krol, Olesya V.; Varushchenko, Raisa M.; Chelovskaya, Nelly V.

    2007-01-01

    Vapour pressures of the ferrocene, ferrocene-methanol, benzyl-ferrocene, and benzoyl-ferrocene have been determined by the transpiration method. The molar enthalpies of sublimation Δ cr g H m and of vaporization Δ l g H m have been determined from the temperature dependence of the vapour pressure. The molar enthalpies of fusion of these compounds were measured by d.s.c. The measured data sets of vaporization, sublimation, and fusion enthalpies were checked for internal consistency

  15. Coal tar creosote abuse by vapour inhalation presenting with renal impairment and neurotoxicity: a case report

    OpenAIRE

    Hiemstra Thomas F; Bellamy Christopher OC; Hughes Jeremy H

    2007-01-01

    Abstract A 56 year old aromatherapist presented with advanced renal failure following chronic coal tar creosote vapour inhalation, and a chronic tubulo-interstitial nephritis was identified on renal biopsy. Following dialysis dependence occult inhalation continued, resulting in seizures, ataxia, cognitive impairment and marked generalised cerebral atrophy. We describe for the first time a case of creosote abuse by chronic vapour inhalation, resulting in significant morbidity. Use of the polyc...

  16. Controlling the magnetism of adsorbed metal-organic molecules.

    Science.gov (United States)

    Kuch, Wolfgang; Bernien, Matthias

    2017-01-18

    Gaining control on the size or the direction of the magnetic moment of adsorbed metal-organic molecules constitutes an important step towards the realization of a surface-mounted molecular spin electronics. Such control can be gained by taking advantage of interactions of the molecule's magnetic moment with the environment. The paramagnetic moments of adsorbed metal-organic molecules, for example, can be controlled by the interaction with magnetically ordered substrates. Metalloporphyrins and -phthalocyanines display a quasi-planar geometry, allowing the central metal ion to interact with substrate electronic states. This can lead to magnetic coupling with a ferromagnetic or even antiferromagnetic substrate. The molecule-substrate coupling can be mediated and controlled by insertion layers such as oxygen atoms, graphene, or nonmagnetic metal layers. Control on the magnetic properties of adsorbed metalloporphyrins or -phthalocyanines can also be gained by on-surface chemical modification of the molecules. The magnetic moment or the magnetic coupling to ferromagnetic substrates can be changed by adsorption and thermal desorption of small molecules that interact with the fourfold-coordinated metal center via the remaining axial coordination site. Spin-crossover molecules, which possess a metastable spin state that can be switched by external stimuli such as temperature or light, are another promising class of candidates for control of magnetic properties. However, the immobilization of such molecules on a solid surface often results in a quench of the spin transition due to the interaction with the substrate. We present examples of Fe(II) spin-crossover complexes in direct contact with a solid surface that undergo a reversible spin-crossover transition as a function of temperature, by illumination with visible light, or can be switched by the tip of a scanning tunneling microscope.

  17. Vapour pressures and densities of the mixed-solvent desiccants (glycols + water + salts)

    Energy Technology Data Exchange (ETDEWEB)

    Chen, L.-F.; Soriano, Allan N. [R and D Center for Membrane Technology and Department of Chemical Engineering, Chung Yuan Christian University, Chung Li, Taiwan (China); Li, M.-H. [R and D Center for Membrane Technology and Department of Chemical Engineering, Chung Yuan Christian University, Chung Li, Taiwan (China)], E-mail: mhli@cycu.edu.tw

    2009-06-15

    The vapour pressures and densities of the mixed-solvent desiccants have been studied for temperatures ranging from (303.15 to 343.15) K. The mixed-solvent desiccants investigated were aqueous-organic systems with salt. The studied organic solvents were diethylene glycol, tetraethylene glycol, and dipropylene glycol. The chosen salts were lithium chloride and lithium bromide. Six ternaries (glycol/water/salt) were selected for this study. For each ternary system, four systems of which (4-25) mass% salt mixed with various glycols (50-80) mass% were investigated. Incorporated with the pseudo-solvent approach, a vapour pressure model based on the mean spherical approximation for aqueous electrolyte solutions was used to represent the measured vapour pressure of glycol/water/salt systems. A simplified density equation was applied to model the measured density of glycol/water/salt systems. Satisfactory results were obtained for vapour pressure and density calculations. The vapour pressures of the aqueous-organic systems with salt yield smaller values of vapour pressures compared to the conventionally used liquid desiccants. The properties obtained and presented in this study are, in general, of sufficient accuracy for most engineering-design calculations, such as the design of dehumidifier process using mixed-solvent desiccants as absorbents.

  18. Stratospheric water vapour in the vicinity of the Arctic polar vortex

    Energy Technology Data Exchange (ETDEWEB)

    Maturilli, M. [Alfred Wegener Institute for Polar and Marine Research, Potsdam (Germany); Fierli, F. [CNR (Italy). Inst. for Atmospheric Sciences and Climate; Yushkov, V.; Lukyanov, A.; Khaykin, S. [Central Aerological Observatory, Moscow (Russian Federation); Hauchecorne, A. [CNRS, Verrieres-le-Buisson (France). Service d' Aeronomie

    2006-07-01

    The stratospheric water vapour mixing ratio inside, outside, and at the edge of the polar vortex has been accurately measured by the FLASH-B Lyman-Alpha hygrometer during the LAUTLOS campaign in Sodankylae, Finland, in January and February 2004. The retrieved H{sub 2}O profiles reveal a detailed view on the Arctic lower stratospheric water vapour distribution, and provide a valuable dataset for the validation of model and satellite data. Analysing the measurements with the semi-lagrangian advection model MIMOSA, water vapour profiles typical for the polar vortex' interior and exterior have been identified, and laminae in the observed profiles have been correlated to filamentary structures in the potential vorticity field. Applying the validated MIMOSA transport scheme to specific humidity fields from operational ECMWF analyses, large discrepancies from the observed profiles arise. Although MIMOSA is able to reproduce weak water vapour filaments and improves the shape of the profiles compared to operational ECMWF analyses, both models reveal a dry bias of about 1 ppmv in the lower stratosphere above 400 K, accounting for a relative difference from the measurements in the order of 20%. The large dry bias in the analysis representation of stratospheric water vapour in the Arctic implies the need for future regular measurements of water vapour in the polar stratosphere to allow the validation and improvement of climate models. (orig.)

  19. Intrinsic stress of bismuth oxide thin films: effect of vapour chopping and air ageing

    International Nuclear Information System (INIS)

    Patil, R B; Puri, R K; Puri, V

    2008-01-01

    Bismuth oxide thin films of thickness 1000 A 0 have been prepared by thermal oxidation (in air) of vacuum evaporated bismuth thin films (on glass substrate) at different oxidation temperatures and duration. Both the vapour chopped and nonchopped bismuth oxide thin films showed polycrystalline and polymorphic structure. The monoclinic bismuth oxide was found to be predominant in both the cases. The effect of vapour chopping and air exposure for 40 days on the intrinsic stress of bismuth oxide thin films has been studied. The vapour chopped films showed low (3.92 - 4.80 x 10 9 N/m 2 ) intrinsic stress than those of nonchopped bismuth oxide thin films (5.77 - 6.74 x 10 9 N/m 2 ). Intrinsic stress was found to increase due to air ageing. The effect of air ageing on the vapour chopped films was found low. The vapour chopped films showed higher packing density. Higher the packing density, lower the film will age. The process of chopping vapour flow creates films with less inhomogenety i.e. a low concentration of flaws and non-planar defects which results in lower intrinsic stress

  20. A rate equation model of stomatal responses to vapour pressure deficit and drought

    Directory of Open Access Journals (Sweden)

    Shanahan ST

    2002-08-01

    Full Text Available Abstract Background Stomata respond to vapour pressure deficit (D – when D increases, stomata begin to close. Closure is the result of a decline in guard cell turgor, but the link between D and turgor is poorly understood. We describe a model for stomatal responses to increasing D based upon cellular water relations. The model also incorporates impacts of increasing levels of water stress upon stomatal responses to increasing D. Results The model successfully mimics the three phases of stomatal responses to D and also reproduces the impact of increasing plant water deficit upon stomatal responses to increasing D. As water stress developed, stomata regulated transpiration at ever decreasing values of D. Thus, stomatal sensitivity to D increased with increasing water stress. Predictions from the model concerning the impact of changes in cuticular transpiration upon stomatal responses to increasing D are shown to conform to experimental data. Sensitivity analyses of stomatal responses to various parameters of the model show that leaf thickness, the fraction of leaf volume that is air-space, and the fraction of mesophyll cell wall in contact with air have little impact upon behaviour of the model. In contrast, changes in cuticular conductance and membrane hydraulic conductivity have significant impacts upon model behaviour. Conclusion Cuticular transpiration is an important feature of stomatal responses to D and is the cause of the 3 phase response to D. Feed-forward behaviour of stomata does not explain stomatal responses to D as feedback, involving water loss from guard cells, can explain these responses.

  1. Insight into the construction of metal-organic polyhedra: Metal-organic cubes as a case study

    KAUST Repository

    Al Kordi, Mohamed

    2011-01-01

    Systematic studies were conducted to gain a better understanding of the metal-organic cubes (MOCs) directed assembly and their crystallization under predetermined reaction conditions, i.e. charge and size of metal ions, solvent type, counter anions, pH, and temperature. Four novel metal-organic materials are constructed via solvothermal reactions of different metal ions and 2,2′-(1H-imidazole-4,5-diyl)di-1,4,5,6-tetrahydropyrimidine, namely [Co8(C11N6H15)12]Cl 12·4H2O (1), [Ni4(C11N 6H15)4](NO3)4· 4DMF (2), {Cd(C11N6H15)(NO3) ·DMF}n (3), and [In8(C11N 6H15)12](NO3)12· 4H2O (4). In addition, syntheses and crystal structures for compounds 1(a-f), constructed under deliberately modified reaction conditions of 1, are reported. In compounds 1(a-f), the CoIII-based cationic MOCs crystallize in various packing arrangements in the presence of different counter-ions. Discrete MOCs retain their structural integrity, when crystalline solid was dissolved in water, under various pH (2.03-8.07) and temperatures (298-333 K), as confirmed by solution NMR studies. The assembly of the discrete MOC, from its basic molecular building blocks under mild reaction conditions, is demonstrated and monitored through solution NMR and UV-vis studies. © The Royal Society of Chemistry 2011.

  2. Simplified Monte Carlo simulations of chemical vapour deposition diamond growth

    Energy Technology Data Exchange (ETDEWEB)

    May, Paul W; Allan, Neil L; Ashfold, Michael N R; Richley, James C [School of Chemistry, University of Bristol, Bristol BS8 1TS (United Kingdom); Mankelevich, Yuri A, E-mail: paul.may@bris.ac.u [Skobel' tsyn Institute of Nuclear Physics, Moscow State University, Vorob' evy gory, Moscow 119991 (Russian Federation)

    2009-09-09

    A simple one-dimensional Monte Carlo model has been developed to simulate the chemical vapour deposition (CVD) of a diamond (100) surface. The model considers adsorption, etching/desorption, lattice incorporation, and surface migration along and across the dimer rows. The top of a step-edge is considered to have an infinite Ehrlich-Schwoebel potential barrier, so that mobile surface species cannot migrate off the edge. The reaction probabilities are taken from experimental or calculated literature values for standard CVD diamond conditions. The criterion used for the critical nucleus needed to form a new layer is considered to be two surface carbon species bonded together, which forms an immobile, unetchable step on the surface. This nucleus can arise from two migrating species meeting, or from direct adsorption of a carbon species next to a migrating species. The analysis includes film growth rate, surface roughness, and the evolving film morphology as a function of varying reaction probabilities. Using standard CVD diamond parameters, the simulations reveal that a smooth film is produced with apparent step-edge growth, with growth rates (approx1 mum h{sup -1}) consistent with experiment. The beta-scission reaction was incorporated into the model, but was found to have very little effect upon growth rates or film morphology. Renucleation events believed to be due to reactive adsorbates, such as C atoms or CN groups, were modelled by creating random surface defects which form another type of critical nucleus upon which to nucleate a new layer. These were found to increase the growth rate by a factor of approx10 when the conditions were such that the rate-limiting step for growth was new layer formation. For other conditions these surface defects led to layered 'wedding cake' structures or to rough irregular surfaces resembling those seen experimentally during CVD of nanocrystalline diamond.

  3. Water vapour and methane coupling in the stratosphere observed using SCIAMACHY solar occultation measurements

    Science.gov (United States)

    Noël, Stefan; Weigel, Katja; Bramstedt, Klaus; Rozanov, Alexei; Weber, Mark; Bovensmann, Heinrich; Burrows, John P.

    2018-04-01

    An improved stratospheric water vapour data set has been retrieved from SCIAMACHY/ENVISAT solar occultation measurements. It is similar to that successfully applied to methane and carbon dioxide. There is now a consistent set of data products for the three constituents covering the altitudes 17-45 km, the latitude range between about 50 and 70° N, and the period August 2002 to April 2012. The new water vapour concentration profiles agree with collocated results from ACE-FTS and MLS/Aura to within ˜ 5 %. A significant positive linear change in water vapour for the time 2003-2011 is observed at lower stratospheric altitudes with a value of about 0.015 ± 0.008 ppmv year-1 around 17 km. Between 30 and 37 km the changes become significantly negative (about -0.01 ± 0.008 ppmv year-1); all errors are 2σ values. The combined analysis of the SCIAMACHY methane and water vapour time series shows the expected anti-correlation between stratospheric methane and water vapour and a clear temporal variation related to the Quasi-Biennial Oscillation (QBO). Above about 20 km most of the additional water vapour is attributed to the oxidation of methane. In addition short-term fluctuations and longer-term variations on a timescale of 5-6 years are observed. The SCIAMACHY data confirm that at lower altitudes the amount of water vapour and methane are transported from the tropics to higher latitudes via the shallow branch of the Brewer-Dobson circulation.

  4. Water vapour and methane coupling in the stratosphere observed using SCIAMACHY solar occultation measurements

    Directory of Open Access Journals (Sweden)

    S. Noël

    2018-04-01

    Full Text Available An improved stratospheric water vapour data set has been retrieved from SCIAMACHY/ENVISAT solar occultation measurements. It is similar to that successfully applied to methane and carbon dioxide. There is now a consistent set of data products for the three constituents covering the altitudes 17–45 km, the latitude range between about 50 and 70° N, and the period August 2002 to April 2012. The new water vapour concentration profiles agree with collocated results from ACE-FTS and MLS/Aura to within  ∼  5 %. A significant positive linear change in water vapour for the time 2003–2011 is observed at lower stratospheric altitudes with a value of about 0.015 ± 0.008 ppmv year−1 around 17 km. Between 30 and 37 km the changes become significantly negative (about −0.01 ± 0.008 ppmv year−1; all errors are 2σ values. The combined analysis of the SCIAMACHY methane and water vapour time series shows the expected anti-correlation between stratospheric methane and water vapour and a clear temporal variation related to the Quasi-Biennial Oscillation (QBO. Above about 20 km most of the additional water vapour is attributed to the oxidation of methane. In addition short-term fluctuations and longer-term variations on a timescale of 5–6 years are observed. The SCIAMACHY data confirm that at lower altitudes the amount of water vapour and methane are transported from the tropics to higher latitudes via the shallow branch of the Brewer–Dobson circulation.

  5. Continuous measurements of isotopic composition of water vapour on the East Antarctic Plateau

    Directory of Open Access Journals (Sweden)

    M. Casado

    2016-07-01

    Full Text Available Water stable isotopes in central Antarctic ice cores are critical to quantify past temperature changes. Accurate temperature reconstructions require one to understand the processes controlling surface snow isotopic composition. Isotopic fractionation processes occurring in the atmosphere and controlling snowfall isotopic composition are well understood theoretically and implemented in atmospheric models. However, post-deposition processes are poorly documented and understood. To quantitatively interpret the isotopic composition of water archived in ice cores, it is thus essential to study the continuum between surface water vapour, precipitation, surface snow and buried snow. Here, we target the isotopic composition of water vapour at Concordia Station, where the oldest EPICA Dome C ice cores have been retrieved. While snowfall and surface snow sampling is routinely performed, accurate measurements of surface water vapour are challenging in such cold and dry conditions. New developments in infrared spectroscopy enable now the measurement of isotopic composition in water vapour traces. Two infrared spectrometers have been deployed at Concordia, allowing continuous, in situ measurements for 1 month in December 2014–January 2015. Comparison of the results from infrared spectroscopy with laboratory measurements of discrete samples trapped using cryogenic sampling validates the relevance of the method to measure isotopic composition in dry conditions. We observe very large diurnal cycles in isotopic composition well correlated with temperature diurnal cycles. Identification of different behaviours of isotopic composition in the water vapour associated with turbulent or stratified regime indicates a strong impact of meteorological processes in local vapour/snow interaction. Even if the vapour isotopic composition seems to be, at least part of the time, at equilibrium with the local snow, the slope of δD against δ18O prevents us from identifying

  6. Relationships of solar radiation and vapour pressure deficit with photosynthesis and water relations in dry-land pigeon pea

    International Nuclear Information System (INIS)

    Subramanian, V.B.; Venkateswarlu, S.; Maheswari, M.; Sankar, G.R.M.

    1994-01-01

    A study was undertaken to compare the relationships of photosynthetically active radiation (PAR) and vapour pressure deficit (VPD) with carbon assimilation and water relations of dry-land pigeon pea at the vegetative and reproductive phases. Photosynthetic rate (Pn), transpiration rate (T), leaf water potential (wL), and stomatal conductance (gs) were measured at 7- to 10-day intervals from 1 month after seedling until a fortnight before harvest during two seasons. Generally, Pn, T, and gs were higher and wL was lower during the reproductive than during the vegetative phase. At high PAR and VPD, Pn, T, wL, and gs decreased. The decrease in the T at high PAR was smaller during the reproductive phase. Growth of dry-land pigeon pea was affected not only during periods of water stress which was associated with high PAR and high VPD but also under conditions of favourable plant water status which were associated with less than optimal levels of PAR. It also showed transpiration efficiency (TE) was lower during the pod-filling than during the vegetative phase, when PAR was optimum

  7. Phase equilibrium data for the ternary system (propane + chloroform + oryzanol)

    Energy Technology Data Exchange (ETDEWEB)

    Correa, Fernanda V.; Comim, Sibele R.R. [EQA/UFSC, Chemical and Food Engineering Department, Federal University of Santa Catarina, C.P. 476, CEP 88040-900, Florianopolis, SC (Brazil); Cesaro, Aline M. de; Rigo, Aline A.; Mazutti, Marcio A. [Department of Food Engineering, URI - Campus de Erechim, Av. Sete de Setembro, 1621, 99700-000 Erechim, RS (Brazil); Hense, Haiko [EQA/UFSC, Chemical and Food Engineering Department, Federal University of Santa Catarina, C.P. 476, CEP 88040-900, Florianopolis, SC (Brazil); Oliveira, J. Vladimir, E-mail: vladimir@uricer.edu.b [Department of Food Engineering, URI - Campus de Erechim, Av. Sete de Setembro, 1621, 99700-000 Erechim, RS (Brazil)

    2011-01-15

    The compound oryzanol available in the rice bran (oriza sativa) is well known for its antioxidant activity. Phase equilibrium data involving oryzanol in compressed fluids, hardly found in the literature, are important to provide the basis for the extraction and fractionation processes. In this sense, the aim of this work is to report phase equilibrium measurements for the system ({gamma}-oryzanol + chloroform) in compressed propane. Phase equilibrium experiments were performed using the static synthetic method (cloud points transition data) in a high-pressure variable-volume view cell in the temperature range of 303 K to 353 K, pressures up to 17 MPa, for oryzanol overall mass fractions of 2 wt%, 5 wt% and 10 wt% in (propane + chloroform) mixtures. A complex phase behaviour comprising vapour-liquid, liquid-liquid, vapour-liquid-liquid, solid-liquid, solid-liquid-liquid, solid-liquid-liquid-vapour transitions were visually observed for the system studied.

  8. Performance analysis of a potassium-steam two stage vapour cycle

    International Nuclear Information System (INIS)

    Mitachi, Kohshi; Saito, Takeshi

    1983-01-01

    It is an important subject to raise the thermal efficiency in thermal power plants. In present thermal power plants which use steam cycle, the plant thermal efficiency has already reached 41 to 42 %, steam temperature being 839 K, and steam pressure being 24.2 MPa. That is, the thermal efficiency in a steam cycle is facing a limit. In this study, analysis was made on the performance of metal vapour/steam two-stage Rankine cycle obtained by combining a metal vapour cycle with a present steam cycle. Three different combinations using high temperature potassium regenerative cycle and low temperature steam regenerative cycle, potassium regenerative cycle and steam reheat and regenerative cycle, and potassium bleed cycle and steam reheat and regenerative cycle were systematically analyzed for the overall thermal efficiency, the output ratio and the flow rate ratio, when the inlet temperature of a potassium turbine, the temperature of a potassium condenser, and others were varied. Though the overall thermal efficiency was improved by lowering the condensing temperature of potassium vapour, it is limited by the construction because the specific volume of potassium in low pressure section increases greatly. In the combinatipn of potassium vapour regenerative cycle with steam regenerative cycle, the overall thermal efficiency can be 58.5 %, and also 60.2 % if steam reheat and regenerative cycle is employed. If a cycle to heat steam with the bled vapor out of a potassium vapour cycle is adopted, the overall thermal efficiency of 63.3 % is expected. (Wakatsuki, Y.)

  9. Supramolecular metal-organic frameworks that display high homogeneous and heterogeneous photocatalytic activity for H2 production

    Science.gov (United States)

    Tian, Jia; Xu, Zi-Yue; Zhang, Dan-Wei; Wang, Hui; Xie, Song-Hai; Xu, Da-Wen; Ren, Yuan-Hang; Wang, Hao; Liu, Yi; Li, Zhan-Ting

    2016-05-01

    Self-assembly has a unique presence when it comes to creating complicated, ordered supramolecular architectures from simple components under mild conditions. Here, we describe a self-assembly strategy for the generation of the first homogeneous supramolecular metal-organic framework (SMOF-1) in water at room temperature from a hexaarmed [Ru(bpy)3]2+-based precursor and cucurbit[8]uril (CB[8]). The solution-phase periodicity of this cubic transition metal-cored supramolecular organic framework (MSOF) is confirmed by small-angle X-ray scattering and diffraction experiments, which, as supported by TEM imaging, is commensurate with the periodicity in the solid state. We further demonstrate that SMOF-1 adsorbs anionic Wells-Dawson-type polyoxometalates (WD-POMs) in a one-cage-one-guest manner to give WD-POM@SMOF-1 hybrid assemblies. Upon visible-light (500 nm) irradiation, such hybrids enable fast multi-electron injection from photosensitive [Ru(bpy)3]2+ units to redox-active WD-POM units, leading to efficient hydrogen production in aqueous media and in organic media. The demonstrated strategy opens the door for the development of new classes of liquid-phase and solid-phase ordered porous materials.

  10. Photo-catalytic studies of transition metal doped titanium dioxide thin films processed by metalorganic decomposition (MOD) method

    Science.gov (United States)

    Talagala, P.; Marko, X.; Padmanabhan, K. R.; Naik, R.; Rodak, D.; Cheng, Y. T.

    2006-03-01

    We have synthesized pure and transition element (Fe, Co and V) doped Titanium oxide thin films of thickness ˜ 350 nm on sapphire, Si, and stainless steel substrates by Metalorganic Decomposition (MOD) method. The films were subsequently annealed at appropriate temperatures ( 500-750C) to obtain either anatase or the rutile phase of TiO2. Analysis of the composition of the films were performed by energy dispersive X-ray(EDAX) and Rutherford backscattering spectrometry(RBS). Ion channeling was used to identify possible epitaxial growth of the films on sapphire. Both XRD and Raman spectra of the films exhibit that the films annealed at 550C are of anatase phase, while those annealed at 700C seem to prefer a rutile structure. The water contact angle measurements of the films before and after photoactivation, demonstrate a significant reduction in the contact angle for the anatase phase. However, the variation in contact angle was observed for films exposed to UV (<10^o-30^o) and dark (25^o-50^o). Films doped with Fe show a trend towards lower contact angle than those doped with Co. Results with films doped with V will also be included.

  11. Structural Transformation and Stabilization of Metal-Organic Motifs Induced by Halogen Doping.

    Science.gov (United States)

    Xie, Lei; Zhang, Chi; Ding, Yuanqi; Xu, Wei

    2017-04-24

    The structural transformation of supramolecular nanostructures with constitutional diversity and adaptability by dynamic coordination chemistry would be of fundamental importance for potential applications in molecular switching devices. The role of halogen doping in the formation of elementary metal-organic motifs on surfaces has not been reported. Now, the 9-ethylguanine molecule (G) and Ni atom, as a model system, are used for the structural transformation and stabilization of metal-organic motifs induced by iodine doping on Au(111). The iodine atoms are homogeneously located at particular hydrogen-rich locations enclosed by G molecules by electrostatic interactions, which would be the key for such an unexpected stabilizing effect. The generality and robustness of this approach are demonstrated in different metal-organic systems (G/Fe) and also by chlorine and bromine. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  12. Metal-organic frameworks for lithium ion batteries and supercapacitors

    Energy Technology Data Exchange (ETDEWEB)

    Ke, Fu-Sheng; Wu, Yu-Shan; Deng, Hexiang, E-mail: hdeng@whu.edu.cn

    2015-03-15

    Porous materials have been widely used in batteries and supercapacitors attribute to their large internal surface area (usually 100–1000 m{sup 2} g{sup −1}) and porosity that can favor the electrochemical reaction, interfacial charge transport, and provide short diffusion paths for ions. As a new type of porous crystalline materials, metal-organic frameworks (MOFs) have received huge attention in the past decade due to their unique properties, i.e. huge surface area (up to 7000 m{sup 2} g{sup −1}), high porosity, low density, controllable structure and tunable pore size. A wide range of applications including gas separation, storage, catalysis, and drug delivery benefit from the recent fast development of MOFs. However, their potential in electrochemical energy storage has not been fully revealed. Herein, the present mini review appraises recent and significant development of MOFs and MOF-derived materials for rechargeable lithium ion batteries and supercapacitors, to give a glimpse into these potential applications of MOFs. - Graphical abstract: MOFs with large surface area and high porosity can offer more reaction sites and charge carriers diffusion path. Thus MOFs are used as cathode, anode, electrolyte, matrix and precursor materials for lithium ion battery, and also as electrode and precursor materials for supercapacitors. - Highlights: • MOFs have potential in electrochemical area due to their high porosity and diversity. • We summarized and compared works on MOFs for lithium ion battery and supercapacitor. • We pointed out critical challenges and provided possible solutions for future study.

  13. Functionalization of silicon nanowire surfaces with metal-organic frameworks

    KAUST Repository

    Liu, Nian

    2011-12-28

    Metal-organic frameworks (MOFs) and silicon nanowires (SiNWs) have been extensively studied due to their unique properties; MOFs have high porosity and specific surface area with well-defined nanoporous structure, while SiNWs have valuable one-dimensional electronic properties. Integration of the two materials into one composite could synergistically combine the advantages of both materials and lead to new applications. We report the first example of a MOF synthesized on surface-modified SiNWs. The synthesis of polycrystalline MOF-199 (also known as HKUST-1) on SiNWs was performed at room temperature using a step-by-step (SBS) approach, and X-ray photoelectron spectroscopy, X-ray diffraction, scanning electron microscopy, transmission electron microscopy, and energy dispersive spectroscopy elemental mapping were used to characterize the material. Matching of the SiNW surface functional groups with the MOF organic linker coordinating groups was found to be critical for the growth. Additionally, the MOF morphology can by tuned by changing the soaking time, synthesis temperature and precursor solution concentration. This SiNW/MOF hybrid structure opens new avenues for rational design of materials with novel functionalities. © 2011 Tsinghua University Press and Springer-Verlag Berlin Heidelberg.

  14. Structural versatility of Metal-organic frameworks: Synthesis and Characterization

    KAUST Repository

    Alsadun, Norah S.

    2017-05-01

    Metal-Organic Frameworks (MOFs), an emerging class of porous crystalline materials, have shown promising properties for diverse applications such as catalysis, gas storage and separation. The high degree of tunability of MOFs vs other solid materials enable the assembly of advanced materials with fascinating properties for specific applications. Nevertheless, the precise control in the construction of MOFs at the molecular level remains challenging. Particularly, the formation of pre-targeted multi-nuclear Molecular Building Block (MBB) precursors to unveil materials with targeted structural characteristics is captivating. The aim of my master project in the continuous quest of the group of Prof. Eddaoudi in exploring different synthetic pathways to control the assembly of Rare Earth (RE) based MOF. After giving a general overview about MOFs, I will discuss in this thesis the results of my work on the use of tri-topic oriented organic carboxylate building units with the aim to explore the assembly/construction of new porous RE based MOFs. In chapter 2 will discuss the assembly of 3-c linkers with RE metals was then evaluated based on symmetry and angularity of the three connected linkers. The focus of chapter 3 is cerium based MOFs and heterometallic system, based on 3-c ligands with different length and symmetry. Overall, the incompatibility of 3-c ligands with the 12-c cuo MBB did not allow to any formation of higher neuclearity (˃6), but it has resulted in affecting the connectivity of the cluster.

  15. Destruction of chemical warfare agents using metal-organic frameworks

    Science.gov (United States)

    Mondloch, Joseph E.; Katz, Michael J.; Isley, William C., III; Ghosh, Pritha; Liao, Peilin; Bury, Wojciech; Wagner, George W.; Hall, Morgan G.; Decoste, Jared B.; Peterson, Gregory W.; Snurr, Randall Q.; Cramer, Christopher J.; Hupp, Joseph T.; Farha, Omar K.

    2015-05-01

    Chemical warfare agents containing phosphonate ester bonds are among the most toxic chemicals known to mankind. Recent global military events, such as the conflict and disarmament in Syria, have brought into focus the need to find effective strategies for the rapid destruction of these banned chemicals. Solutions are needed for immediate personal protection (for example, the filtration and catalytic destruction of airborne versions of agents), bulk destruction of chemical weapon stockpiles, protection (via coating) of clothing, equipment and buildings, and containment of agent spills. Solid heterogeneous materials such as modified activated carbon or metal oxides exhibit many desirable characteristics for the destruction of chemical warfare agents. However, low sorptive capacities, low effective active site loadings, deactivation of the active site, slow degradation kinetics, and/or a lack of tailorability offer significant room for improvement in these materials. Here, we report a carefully chosen metal-organic framework (MOF) material featuring high porosity and exceptional chemical stability that is extraordinarily effective for the degradation of nerve agents and their simulants. Experimental and computational evidence points to Lewis-acidic ZrIV ions as the active sites and to their superb accessibility as a defining element of their efficacy.

  16. Surface nano-architecture of a metal-organic framework.

    Science.gov (United States)

    Makiura, Rie; Motoyama, Soichiro; Umemura, Yasushi; Yamanaka, Hiroaki; Sakata, Osami; Kitagawa, Hiroshi

    2010-07-01

    The rational assembly of ultrathin films of metal-organic frameworks (MOFs)--highly ordered microporous materials--with well-controlled growth direction and film thickness is a critical and as yet unrealized issue for enabling the use of MOFs in nanotechnological devices, such as sensors, catalysts and electrodes for fuel cells. Here we report the facile bottom-up fabrication at ambient temperature of such a perfect preferentially oriented MOF nanofilm on a solid surface (NAFS-1), consisting of metalloporphyrin building units. The construction of NAFS-1 was achieved by the unconventional integration in a modular fashion of a layer-by-layer growth technique coupled with the Langmuir-Blodgett method. NAFS-1 is endowed with highly crystalline order both in the out-of-plane and in-plane orientations to the substrate, as demonstrated by synchrotron X-ray surface crystallography. The proposed structural model incorporates metal-coordinated pyridine molecules projected from the two-dimensional sheets that allow each further layer to dock in a highly ordered interdigitated manner in the growth of NAFS-1. We expect that the versatility of the solution-based growth strategy presented here will allow the fabrication of various well-ordered MOF nanofilms, opening the way for their use in a range of important applications.

  17. Shock Wave Energy Dissipation by Metal-Organic Framework

    Science.gov (United States)

    Zhou, Xuan; Miao, Yurun; Banlusan, Kiettipong; Shaw, William; Strachan, Alejandro; Suslick, Kenneth; Dlott, Dana

    2017-06-01

    Metal-organic framework (MOF) such as ZIF-8 and UiO-66 show promising shock energy dissipation abilities through mechano-chemical reactions including bond breaking and pore collapse. In this work, we performed quantitative measurements on the shock wave energy attenuated by MOF films using a laser-driven flyer-plate apparatus. Aluminum flyer plates of 75-um thick were accelerated to speeds up to 2.0 km/s by a flat-top pulsed laser to impact the MOF film. The MOF layer was coated on a 200-nm thick gold mirror, which was deposited previously on glass substrate. Photonic Doppler velocimetry (PDV) was used to track the motions of the gold mirror, which can be converted to the energy flux and fluence of the shock wave that transmitted through the MOF layer. We deduced the shock energy that was attenuated by the MOF film by comparing the transmitted energy flux/fluence obtained with and without the presence of the MOF layer. A two-wave-shaped flux-time curve was obtained with the MOF layer because of its nanoporous structure. Studies on the shock wave energy attenuation by ZIF-8 and UiO-66 were carried out under various flyer speeds and sample thicknesses. We used in situ emission spectroscopy to verify that pore collapse was accompanied by chemical bond breakage. Corresponding author:dlott@illinois.edu.

  18. Controlling Thermal Expansion: A Metal-Organic Frameworks Route.

    Science.gov (United States)

    Balestra, Salvador R G; Bueno-Perez, Rocio; Hamad, Said; Dubbeldam, David; Ruiz-Salvador, A Rabdel; Calero, Sofia

    2016-11-22

    Controlling thermal expansion is an important, not yet resolved, and challenging problem in materials research. A conceptual design is introduced here, for the first time, for the use of metal-organic frameworks (MOFs) as platforms for controlling thermal expansion devices that can operate in the negative, zero, and positive expansion regimes. A detailed computer simulation study, based on molecular dynamics, is presented to support the targeted application. MOF-5 has been selected as model material, along with three molecules of similar size and known differences in terms of the nature of host-guest interactions. It has been shown that adsorbate molecules can control, in a colligative way, the thermal expansion of the solid, so that changing the adsorbate molecules induces the solid to display positive, zero, or negative thermal expansion. We analyze in depth the distortion mechanisms, beyond the ligand metal junction, to cover the ligand distortions, and the energetic and entropic effect on the thermo-structural behavior. We provide an unprecedented atomistic insight on the effect of adsorbates on the thermal expansion of MOFs as a basic tool toward controlling the thermal expansion.

  19. Luminescent multifunctional lanthanides-based metal-organic frameworks.

    Science.gov (United States)

    Rocha, João; Carlos, Luís D; Paz, Filipe A Almeida; Ananias, Duarte

    2011-02-01

    Metal-organic frameworks based on trivalent lanthanides (LnMOFs) are a very promising class of materials for addressing the challenges in engineering of luminescent centres. Lanthanide-bearing phosphors find numerous applications in lighting, optical communications, photonics and biomedical devices. In this critical review we discuss the potential of LnMOFs as multifunctional systems, which combine light emission with properties such as microporosity, magnetism, chirality, molecule and ion sensing, catalysis and activity as multimodal imaging contrast agents. We argue that these materials present a unique chance of observing synergy between several of these properties, such as the coupling between photoluminescence and magnetism. Moreover, an integrated approach towards the design of efficient, stable, cheap, environmentally-friendly and multifunctional luminescent LnMOFs is still missing. Although research into LnMOFs is at its early stage and much basic knowledge is still needed, the field is ripe for new ideas, which will enable sensor devices and photonic prototypes to become a commercial reality (81 references).

  20. Increasing the Stability of Metal-Organic Frameworks

    Directory of Open Access Journals (Sweden)

    Mathieu Bosch

    2014-01-01

    Full Text Available Metal-organic frameworks (MOFs are a new category of advanced porous materials undergoing study by many researchers for their vast variety of both novel structures and potentially useful properties arising from them. Their high porosities, tunable structures, and convenient process of introducing both customizable functional groups and unsaturated metal centers have afforded excellent gas sorption and separation ability, catalytic activity, luminescent properties, and more. However, the robustness and reactivity of a given framework are largely dependent on its metal-ligand interactions, where the metal-containing clusters are often vulnerable to ligand substitution by water or other nucleophiles, meaning that the frameworks may collapse upon exposure even to moist air. Other frameworks may collapse upon thermal or vacuum treatment or simply over time. This instability limits the practical uses of many MOFs. In order to further enhance the stability of the framework, many different approaches, such as the utilization of high-valence metal ions or nitrogen-donor ligands, were recently investigated. This review details the efforts of both our research group and others to synthesize MOFs possessing drastically increased chemical and thermal stability, in addition to exemplary performance for catalysis, gas sorption, and separation.

  1. Rapid thermal metalorganic chemical vapor deposition of II VI compounds

    Science.gov (United States)

    Stolyarova, S.; Amir, N.; Nemirovsky, Y.

    1998-02-01

    In this paper we analyze the potential benefits of rapid thermal processing combined with metalorganic chemical vapor deposition (RT-MOCVD) for II-VI compounds and review our first results of the application of RT-MOCVD to the growth of CdTe/CdZnTe, CdTe/HgCdTe and ZnTe/CdTe heterostructures. The RT-MOCVD growth of (1 1 1) CdTe and ZnTe was performed in the A.G. Associates Heatpulse CVD-800™ system using a horizontal quartz reactor heated from both sides by tungsten-halogen lamps. The main features of RT-MOCVD of II-VI materials are: very high growth rates (up to 60 μm/h for CdTe and 30 μm/h for ZnTe); low point defect densities in the epilayers; more abrupt interfaces and less substrate surface degradation compared to conventional MOCVD. Potential of RT-MOCVD for MCT passivation has been shown.

  2. Characterisation and vapour sensing properties of spin coated thin films of anthracene labelled PMMA polymer

    Energy Technology Data Exchange (ETDEWEB)

    Capan, I., E-mail: inci.capan@gmail.com [Balikesir University, Faculty of Art and Sciences, Department of Physics, Cagis Campus, 10145 Balikesir (Turkey); Tarimci, C., E-mail: Celik.Tarimci@eng.ankara.edu.tr [Ankara University, Faculty of Engineering, Department of Engineering Physics, 06100, Ankara (Turkey); Erdogan, M., E-mail: merdogan@balikesir.edu.tr [Balikesir University, Faculty of Art and Sciences, Department of Physics, Cagis Campus, 10145 Balikesir (Turkey); Hassan, A.K., E-mail: A.Hassan@shu.ac.uk [Materials and Engineering Research Institute, Sheffield Hallam University, Sheaf Building, Pond Street, Sheffield S1 1WB (United Kingdom)

    2009-05-05

    In the present article thin films of poly (methyl methacrylate) (PMMA) polymer labelled with anthracene (Ant-PMMA) prepared by spin coating are characterised by UV-visible spectroscopy, surface plasmon resonance (SPR), spectroscopic ellipsometry (SE) and Atomic Force Microscopy (AFM) and their organic vapour sensing properties are investigated. Ant-PMMA films' thickness are determined by performing theoretical fitting to experimental data measured using SPR and SE. Results obtained show that the spin-cast films are of good uniformity with an average thickness of 6-8 nm. Organic vapour sensing properties are studied using SPR technique during exposures to different volatile organic compounds (VOCs). Ant-PMMA films' response to the selected VOCs has been examined in terms of solubility parameters and molar volumes of the solvents, and the films were found to be largely sensitive to benzene vapour compared to other studied analytes.

  3. Characterisation and vapour sensing properties of spin coated thin films of anthracene labelled PMMA polymer

    International Nuclear Information System (INIS)

    Capan, I.; Tarimci, C.; Erdogan, M.; Hassan, A.K.

    2009-01-01

    In the present article thin films of poly (methyl methacrylate) (PMMA) polymer labelled with anthracene (Ant-PMMA) prepared by spin coating are characterised by UV-visible spectroscopy, surface plasmon resonance (SPR), spectroscopic ellipsometry (SE) and Atomic Force Microscopy (AFM) and their organic vapour sensing properties are investigated. Ant-PMMA films' thickness are determined by performing theoretical fitting to experimental data measured using SPR and SE. Results obtained show that the spin-cast films are of good uniformity with an average thickness of 6-8 nm. Organic vapour sensing properties are studied using SPR technique during exposures to different volatile organic compounds (VOCs). Ant-PMMA films' response to the selected VOCs has been examined in terms of solubility parameters and molar volumes of the solvents, and the films were found to be largely sensitive to benzene vapour compared to other studied analytes.

  4. Kinetic model of water vapour adsorption by gluten-free starch

    Science.gov (United States)

    Ocieczek, Aneta; Kostek, Robert; Ruszkowska, Millena

    2015-01-01

    This study evaluated the kinetics of water vapour adsorption on the surface of starch molecules derived from wheat. The aim of the study was to determine an equation that would allow estimation of water content in tested material in any timepoint of the adsorption process aimed at settling a balance with the environment. An adsorption isotherm of water vapour on starch granules was drawn. The parameters of the Guggenheim, Anderson, and De Boer equation were determined by characterizing the tested product and adsorption process. The equation of kinetics of water vapour adsorption on the surface of starch was determined based on the Guggenheim, Anderson, and De Boer model describing the state of equilibrium and on the model of a first-order linear inert element describing the changes in water content over time.

  5. Distribution of tritium in water vapour and precipitation around Wolsung nuclear power plant.

    Science.gov (United States)

    Chae, Jung-Seok; Lee, Sang-Kuk; Kim, Yongjae; Lee, Jung-Min; Cho, Heung-Joon; Cho, Yong-Woo; Yun, Ju-Yong

    2011-07-01

    The distribution of tritium in water vapour and precipitation with discharge of tritiated water vapour and meteorological factors was studied around the Wolsung nuclear power plant (NPP) site during the period 2004-2008. The tritium concentrations in atmospheric water vapour and precipitation had a temporal variation with relatively high values in the early summer. Spatial distribution of tritium concentrations was affected by various factors such as distance from the NPP site, wind direction, tritium discharge into the atmosphere and atmospheric dispersion factor. The annual mean concentrations of atmospheric HTO and precipitation were correlated with the amount of gaseous tritium released from the Wolsung NPP. The tritium concentrations in precipitation decrease exponentially with an increase of the distance from the Wolsung NPP site.

  6. Vapours of US and EU Market Leader Electronic Cigarette Brands and Liquids Are Cytotoxic for Human Vascular Endothelial Cells.

    Directory of Open Access Journals (Sweden)

    Raphaela Putzhammer

    Full Text Available The present study was conducted to provide toxicological data on e-cigarette vapours of different e-cigarette brands and liquids from systems viewed as leaders in the e-cigarette market and to compare e-cigarette vapour toxicity to the toxicity of conventional strong high-nicotine cigarette smoke. Using an adapted version of a previously constructed cigarette smoke constituent sampling device, we collected the hydrophilic fraction of e-cigarette vapour and exposed human umbilical vein endothelial cells (HUVECs to the mixture of compounds present in the vapour of 4 different single-use e-cigarettes, 6 different liquid vapours produced by the same refillable e-cigarette, and one e-cigarette with an exchangeable liquid cartridge. After incubation of cells with various concentrations and for various periods of time we analysed cell death induction, proliferation rates, the occurrence of intra-cellular reactive oxygen species, cell morphology, and we also measured e-cigarette heating coil temperatures. Overall, conventional cigarette smoke extract showed the most severe impact on endothelial cells. However, some e-cigarette vapour extracts showed high cytotoxicity, inhibition of cell proliferation, and alterations in cell morphology, which were comparable to conventional high-nicotine cigarettes. The vapours generated from different liquids using the same e-cigarette show substantial differences, pointing to the liquids as an important source for toxicity. E-cigarette vapour-mediated induction of oxidative stress was significant in one out of the 11 analysed vapours. There is a high variability in the acute cytotoxicity of e-cigarette vapours depending on the liquid and on the e-cigarettes used. Some products showed toxic effects close to a conventional high-nicotine cigarette. Liquid nicotine, menthol content, and the formation of acute intracellular reactive oxygen species do not seem to be the central elements in e-cigarette vapour toxicity.

  7. Highly porous Co(II)-salicylate metal-organic framework: synthesis, characterization and magnetic properties.

    Science.gov (United States)

    Das, Swapan K; Bhunia, Manas K; Motin Seikh, Md; Dutta, Saurav; Bhaumik, Asim

    2011-03-28

    A new porous Co(II)-salicylate metal-organic framework material has been synthesized hydrothermally through the reaction of Co(II) chloride with sodium salicylate under mild alkaline pH conditions. To get an idea about the structural aspect of the material from the powder X-ray diffraction (PXRD) pattern, MAUD program has been successfully utilized and the assigned peaks match very well with a new tetragonal phase (space group, P4mm) having the unit cell parameters: a = b = 12.957 (0.042) Å; c = 12.738 (0.019) Å; α = β = γ = 90°, V = 2138.73 Å(3). N(2) adsorption/desorption analyses suggested the material is highly porous in nature having high BET surface area and pore dimensions of 2.0-3.0 nm, which is within the range of small mesopores. Thermogravimetric analysis (TGA) revealed that the H(2)O molecules may be removed from the framework without collapsing the structure and the material is stable up to ca. 573 K. The material is characterized thoroughly by using different characterization tools such as TEM, SEM, UV-visible reflectance spectroscopy, FT IR spectroscopy and photoluminescence spectroscopy. X-Ray photoelectron spectroscopic (XPS) analysis was employed to understand the oxidation state of the cobalt atom and presence of other elements within the framework. The material shows interesting magnetic properties, where the magnetic moments monotonically increase with the decrease in temperature down to 9 K. Below 9 K there is a steep increase in magnetization on further lowering the temperature, thereby suggesting the onset of a long range ferromagnetic transition with ferromagnetic Curie temperature, T(C) = 8.5 K. Furthermore, the M-H curve at 2 K shows a clear hysteresis loop with a coercive field 150 Oe and remnant magnetization 0.8 μ(B)/f.u.

  8. Pillared-Layer Metal-Organic Frameworks for Improved Lithium-Ion Storage Performance.

    Science.gov (United States)

    Gong, Teng; Lou, Xiaobing; Gao, En-Qing; Hu, Bingwen

    2017-07-05

    Recently, more and more metal-organic frameworks (MOFs) have been directly used as anodic materials in lithium-ion batteries, but judicious design or choice of MOFs is still challenging for lack of structural-property knowledge. In this article we propose a pillared-layer strategy to achieve improved Li-storage performance. Four Mn(II) and Co(II) MOFs with mixed azide and carboxylate ligands were studied to illustrate the strategy. In these 3D MOFs, layers (1, 3, and 4) or chains (2) with short bridges are linked by long organic spacers. All the MOFs show very high lithiation capacity (1170-1400 mA h g -1 at 100 mA g -1 ) in the first cycle owing to the rich insertion sites arising from the azide ion and the aromatic ligands. After the formation cycles, the reversible capacities of the anodes from 1, 3, and 4 are kept at a high level (580-595 mA h g -1 ) with good rate and cycling performance, while the anode from 2 undergoes a dramatic drop in capacity. All the MOFs lose the crystallinity after the first cycle. While the amorphization of the chain-based framework of 2 leads to major irreversible deposit of Li ions, the amorphous phases derived from the pillared-layer frameworks of 1, 3, and 4 still retain rich accessible space for reversible insertion and diffusion of active Li ions. Consistent with the analysis, electrochemical impedance spectra revealed that the pillared-layer MOFs led to significantly smaller charge-transfer resistances than 2. Soft X-ray absorption spectroscopy suggested that no metal conversion is involved in the lithiation process, consistent with the fact that the isomorphous Co(II) (3) and Mn(II) (4) MOFs are quite similar in anodic performance.

  9. WATER VAPOUR PERMEABILITY PROPERTIES OF CELLULAR WOOD MATERIAL AND CONDENSATION RISK OF COMPOSITE PANEL WALLS

    Directory of Open Access Journals (Sweden)

    Janis IEJAVS

    2016-09-01

    Full Text Available Invention of light weight cellular wood material (CWM with a trade mark of Dendrolight is one of innovations in wood industry of the last decade. The aim of the research was to define the water vapour permeability properties of CWM and to analyse the condensation risk of various wall envelopes where solid wood cellular material is used. To determine the water vapour permeability of CWM, test samples were produced in the factory using routine production technology and tested according to the standard EN 12086:2014. Water vapour permeability factor (μ and other properties of six different configurations of CWM samples were determined. Using the experimental data the indicative influence of geometrical parameters such as lamella thickness, number of lamellas and material direction were investigated and evaluated. To study the condensation risk within the wall envelope containing CWM calculation method given in LVS EN ISO 13788:2012 was used. To ease the calculation process previously developed JavaScript calculation software that had only capability to calculate thermal transmittance was extended so that condensation risk in multi-layer composite walls can be analysed. Water vapour permeability factor in CWM is highly direction dependant. If parallel and perpendicular direction of CWM is compared the value of water vapour permeability factor can differentiate more than two times. Another significant factor for condensation risk analysis is overall thickness of CWM since it directly influences the equivalent air layer thickness. The influence of other factors such as lamella thickness, or groove depth is minor when water vapour permeability properties are compared. From the analysis of CWM performance in building envelope it can be concluded that uninsulated CWM panels used during winter months will pose the risk of condensation damage to structure, but the risk can be reduced or prevented if insulation layer is applied to the CWM panel wall

  10. Intercomparison of atmospheric water vapour measurements at a Canadian High Arctic site

    Science.gov (United States)

    Weaver, Dan; Strong, Kimberly; Schneider, Matthias; Rowe, Penny M.; Sioris, Chris; Walker, Kaley A.; Mariani, Zen; Uttal, Taneil; McElroy, C. Thomas; Vömel, Holger; Spassiani, Alessio; Drummond, James R.

    2017-08-01

    Water vapour is a critical component of the Earth system. Techniques to acquire and improve measurements of atmospheric water vapour and its isotopes are under active development. This work presents a detailed intercomparison of water vapour total column measurements taken between 2006 and 2014 at a Canadian High Arctic research site (Eureka, Nunavut). Instruments include radiosondes, sun photometers, a microwave radiometer, and emission and solar absorption Fourier transform infrared (FTIR) spectrometers. Close agreement is observed between all combination of datasets, with mean differences ≤ 1.0 kg m-2 and correlation coefficients ≥ 0.98. The one exception in the observed high correlation is the comparison between the microwave radiometer and a radiosonde product, which had a correlation coefficient of 0.92.A variety of biases affecting Eureka instruments are revealed and discussed. A subset of Eureka radiosonde measurements was processed by the Global Climate Observing System (GCOS) Reference Upper Air Network (GRUAN) for this study. Comparisons reveal a small dry bias in the standard radiosonde measurement water vapour total columns of approximately 4 %. A recently produced solar absorption FTIR spectrometer dataset resulting from the MUSICA (MUlti-platform remote Sensing of Isotopologues for investigating the Cycle of Atmospheric water) retrieval technique is shown to offer accurate measurements of water vapour total columns (e.g. average agreement within -5.2 % of GRUAN and -6.5 % of a co-located emission FTIR spectrometer). However, comparisons show a small wet bias of approximately 6 % at the high-latitude Eureka site. In addition, a new dataset derived from Atmospheric Emitted Radiance Interferometer (AERI) measurements is shown to provide accurate water vapour measurements (e.g. average agreement was within 4 % of GRUAN), which usefully enables measurements to be taken during day and night (especially valuable during polar night).

  11. Multirate delivery of multiple therapeutic agents from metal-organic frameworks

    Directory of Open Access Journals (Sweden)

    Alistair C. McKinlay

    2014-12-01

    Full Text Available The highly porous nature of metal-organic frameworks (MOFs offers great potential for the delivery of therapeutic agents. Here, we show that highly porous metal-organic frameworks can be used to deliver multiple therapeutic agents—a biologically active gas, an antibiotic drug molecule, and an active metal ion—simultaneously but at different rates. The possibilities offered by delivery of multiple agents with different mechanisms of action and, in particular, variable timescales may allow new therapy approaches. Here, we show that the loaded MOFs are highly active against various strains of bacteria.

  12. Neutron powder diffraction of metal-organic frameworks for hydrogen storage

    International Nuclear Information System (INIS)

    Brown, Craig M.; Liu, Yun; Neumann, Dan A.

    2008-01-01

    We review recent structural studies that we have undertaken aimed at elucidating the fundamental properties of metal-organic framework materials and their interactions with hydrogen. We have shown that exposing coordinatively unsaturated metal centers can greatly enhance the hydrogen binding energy and that they result in a significant increase of the surface packing density of adsorbed hydrogen molecules on materials surface. We will review some of the structural aspects of these materials, especially the adsorbed hydrogen molecule surface packing density in one type of metal-organic framework, MOF-74, which can be packed even denser than that in solid hydrogen. (author)

  13. A multiferroic material [NH2-CH+-NH2]Co(HCOO3 of metal-organic frameworks with weak ferromagnetism and dielectric relaxation

    Directory of Open Access Journals (Sweden)

    Jiangqi Luo

    2017-10-01

    Full Text Available In order to seek for the single-phase multiferroic metal-organic frameworks (MOFs materials, we prepared a multiferroic material [NH2-CH+-NH2]Co(HCOO3 (FMDCo by solvothermal method. We found that it had weak ferromagnetism below 12.5 K with the coercive fields (Hc of 560 Oe, remnant magnetization (Mr of 7.67 emu/g and saturation magnetization (Ms of 10.3 emu/g and exhibited obvious dielectric relaxation. The octahedral metal ions (Co2+ were linked by formate (HCOO- ligands. The AmineH+ cation (NH2-CH+-NH2 were located within the cube-like cavities of the framework and formed extensive hydrogen bonds with the framework. This improved the phase transition temperature and thermal stability. This finding helps to understand the nature of magnetic and electric ordering in the MOFs.

  14. Thermal diffusion of water vapour in porous materials: fact or fiction?

    DEFF Research Database (Denmark)

    Janssen, Hans

    2011-01-01

    The reliable evaluation of moisture transfer in porous materials is essential in many engineering applications, among which building science. One key aspect is a correct description of moisture flow phenomena and their transport potentials. While different issues can be debated in that respect...... its negligible magnitude. It can in conclusion be stated that thermal diffusion is of no importance for building science applications, leaving vapour pressure as the sole significant transport potential for the diffusion of water vapour in porous materials. (C) 2010 Elsevier Ltd. All rights reserved....

  15. Oxidation of X20 in Water Vapour: The Effect of Temperature and Oxygen Partial Pressure

    DEFF Research Database (Denmark)

    Hansson, Anette Nørgaard; Montgomery, Melanie; Somers, Marcel A. J.

    2009-01-01

    The oxidation behaviour of X20 in various mixtures of water, oxygen and hydrogen was investigated at temperatures between 500 C and 700 C (time: 336 h). The samples were characterised using reflected light microscopy and scanning electron microscopy equipped with energy dispersive spectroscopy....... Double-layered oxides developed during oxidation under all conditions. The morphology of the oxide layers was strongly influenced by temperature, whereas the influence of the oxidising environment appeared to be less pronounced, as long as it contained water vapour. The inner layer consisted of converted...... are discussed based on the various hypotheses of the accelerating effect of water vapour that have been put forth in the literature....

  16. SPATIO-TEMPORAL ESTIMATION OF INTEGRATED WATER VAPOUR OVER THE MALAYSIAN PENINSULA DURING MONSOON SEASON

    Directory of Open Access Journals (Sweden)

    S. Salihin

    2017-10-01

    Full Text Available This paper provides the precise information on spatial-temporal distribution of water vapour that was retrieved from Zenith Path Delay (ZPD which was estimated by Global Positioning System (GPS processing over the Malaysian Peninsular. A time series analysis of these ZPD and Integrated Water Vapor (IWV values was done to capture the characteristic on their seasonal variation during monsoon seasons. This study was found that the pattern and distribution of atmospheric water vapour over Malaysian Peninsular in whole four years periods were influenced by two inter-monsoon and two monsoon seasons which are First Inter-monsoon, Second Inter-monsoon, Southwest monsoon and Northeast monsoon.

  17. Applicability of chemical vapour polishing of additive manufactured parts to meet production-quality

    DEFF Research Database (Denmark)

    Pedersen, D. B.; Hansen, H. N.; Nielsen, J. S.

    2014-01-01

    The Fused Deposition Modelling (FDM) method is the most rapidly growing Additive Manufacturing (AM) method[1]. FDM employs a 2.5D deposition scheme which induce a step-ladder shaped surface definition [2], with seams of the individual layers clearly visible[3]. This paper investigate to which...... extend chemical vapour polishing can be applied to eliminate the layered surfaces from FDM, so that a polished surface quality is obtained. It is quantified to what extend parts can be vapour polished and how geometrical and mechanical properties alter. The fundamental question is whether the surfaces...... of FDM manufactured parts can be taken from their current quality into the precision engineering domain....

  18. Effect of Liquid/Vapour Maldistribution on the Performance of Plate Heat Exchanger Evaporators

    DEFF Research Database (Denmark)

    Jensen, Jonas Kjær; Kærn, Martin Ryhl; Ommen, Torben Schmidt

    2015-01-01

    Plate heat exchangers are often applied as evaporators in industrial refrigeration and heat pump systems. In the design and modelling of such heat exchangers the flow and liquid/vapour distribution is often assumed to be ideal. However, maldistribution may occur and will cause each channel...... to behave differently due to the variation of the mass flux and vapour quality. To evaluate the effect of maldistribution on the performance of plate heat exchangers, a numerical model is developed in which the mass, momentum and energy balances are applied individually to each channel, including suitable...

  19. Study of the initiation and the escalade phases of a vapour explosion

    International Nuclear Information System (INIS)

    Lamome, J.

    2007-09-01

    The steam explosion triggering issue is discussed here by studying at the thermal fragmentation (small pressure perturbation) of a hot water droplet surrounded by a stable steam film. Fragmentation seems to be the consequence of local contacts between the droplet and the coolant. However, the exact mechanism altering the droplet following the above mentioned contacts is uncertain. After a study of the proportions in place, we realized a contact can fragment the droplet in a very short period of time. Therefore, we adopted an approach considering the contact as the explosion criteria. In order to validate this approach, we researched the explosion levels of the experimental variations based on the surrounding pressure and on the coolant's temperature. The model found again the experimental variations, the levels were found again with some uncertainty. The contact is obtained by 2 mechanisms inducing liquid's proximity: a steam film global compression due to the disturbance and the amplification of the interface defaults between the coolant and the steam. It appears it is the mechanism of global compression that explains mostly the experimental variations. Following these results, we conducted model's extrapolations in order to come as close as possible of the conditions in which steam explosion can occur on an industrial scale (i.e. in the water pressured nuclear reactors). (author)

  20. Thick film titania on glass supports for vapour phase photocatalytic degradation of toluene, acetone, and ethanol

    Czech Academy of Sciences Publication Activity Database

    Neti, R.N.; Parmar, G.R.; Bakardjieva, Snejana; Šubrt, Jan

    2010-01-01

    Roč. 163, č. 3 (2010), s. 219-229 ISSN 1385-8947 Institutional research plan: CEZ:AV0Z40320502 Keywords : titania photocatalyst * thick films * glass support Subject RIV: CA - Inorganic Chemistry Impact factor: 3.074, year: 2010

  1. Vapour phase alkylation of ethylbenzene with t-butyl alcohol over ...

    Indian Academy of Sciences (India)

    --BVB, an unexpected product in this investigation, was produced by dehydrogenation of --BEB over alumina particles present in the channels of the molecular sieves. Adsorption of ethylbenzene on Brønsted acid sites and its subsequent reaction with very closely adsorbed -butyl cations proved to be necessary to ...

  2. Materials and vapour-phase techniques for the synthesis of ceramic coatings

    Directory of Open Access Journals (Sweden)

    Albella, J. M.

    2007-08-01

    Full Text Available A survey on recent advances in the synthesis of hard ceramic coatings is given, including materials processes and techniques. Emphasis is made on the parameters which control the coating properties (crystalline structure, morphology, etc, namely arrival energy of the atoms to the growing surface and substrate temperature. Some relevant coating materials are discussed in relation to their applications either as hard protective coatings or with decorative purposes, namely: the family of metal nitrides, carbides, and oxides, in different layer structures (monolithic, multilayers and nanocomposites and ternary compounds of the BCN system.

    Se hace un descripción de los avances recientes en la síntesis de recubrimientos duros de tipo cerámico, depositados mediante técnicas de deposición en fase vapor. Se dedica especial atención a los parámetros del proceso de deposición que controlan las propiedades finales de las capas (estructura cristalina, morfología, etc, tales como la energía de llegada de los átomos a las superficie en crecimiento, y la temperatura. Finalmente, se hace una revisión de los materiales más relevantes en lo que se refiere a sus aplicaciones como recubrimientos duros y protectores, o como recubrimientos decorativos, entre ellos, la familia de los nitruros, carburos y óxidos metálicos, depositados en diversos tipos de estructuras (monolíticas, multicapas y nanocomposites, y los compuestos ternarios del sistema BCN.

  3. Micro-calorimetric sensor for vapour phase explosive detection with optimized heat profile

    DEFF Research Database (Denmark)

    Greve, Anders; Olsen, Jesper Kenneth; Boisen, Anja

    2009-01-01

    A heater design, used in a micro-calorimetric sensor, has been optimized for temperature uniformity and the sensor has been used for detection of trace amounts of explosives. In this abstract the design, characterization and functionality is described. The performance of the novel heater design...... is characterized by measuring the temperature coefficient of resistivity (TCR) values and by mapping the temperature distribution using Raman spectroscopy. The new heater design has increased the temperature uniformity and calorimetric measurements on DNT (2,4-Dinitrotoluene) show more reproducible and better...

  4. Vapour phase alkylation of ethylbenzene with t-butyl alcohol over ...

    Indian Academy of Sciences (India)

    Unknown

    a Nicolet 800 FTIR spectrophotometer by the KBr pellet technique. .... The absence of styrene at all temperatures might be due to its high reactivity with t- butyl cation ... styrene was 13⋅5%. Hence styrene might also be formed in the original reaction within the channel which rapidly reacts with t-butyl cation to yield p-t-BVB.

  5. Vapour phase alkylation of ethylbenzene with t-butyl alcohol over ...

    Indian Academy of Sciences (India)

    Unknown

    BEB. p-t-BVB, an unexpected product in this investigation, was produced by dehydrogenation of p-t-BEB over alumina particles present in the channels of the ... catalyst, and to the easy diffusion that aids escape of the product without multi- substitution. In addition, MCM-41 can provide similar spatial environment for the.

  6. On the dielectric and optical properties of surface-anchored metal-organic frameworks: A study on epitaxially grown thin films

    Science.gov (United States)

    Redel, Engelbert; Wang, Zhengbang; Walheim, Stefan; Liu, Jinxuan; Gliemann, Hartmut; Wöll, Christof

    2013-08-01

    We determine the optical constants of two highly porous, crystalline metal-organic frameworks (MOFs). Since it is problematic to determine the optical constants for the standard powder modification of these porous solids, we instead use surface-anchored metal-organic frameworks (SURMOFs). These MOF thin films are grown using liquid phase epitaxy (LPE) on modified silicon substrates. The produced SURMOF thin films exhibit good optical properties; these porous coatings are smooth as well as crack-free, they do not scatter visible light, and they have a homogenous interference color over the entire sample. Therefore, spectroscopic ellipsometry (SE) can be used in a straightforward fashion to determine the corresponding SURMOF optical properties. After careful removal of the solvent molecules used in the fabrication process as well as the residual water adsorbed in the voids of this highly porous solid, we determine an optical constant of n = 1.39 at a wavelength of 750 nm for HKUST-1 (stands for Hong Kong University of Science and Technology-1; and was first discovered there) or [Cu3(BTC)2]. After exposing these SURMOF thin films to moisture/EtOH atmosphere, the refractive index (n) increases to n = 1.55-1.6. This dependence of the optical properties on water/EtOH adsorption demonstrates the potential of such SURMOF materials for optical sensing.

  7. Single liquid source plasma-enhanced metalorganic chemical vapor deposition of high-quality YBa2Cu3O(7-x) thin films

    Science.gov (United States)

    Zhang, Jiming; Gardiner, Robin A.; Kirlin, Peter S.; Boerstler, Robert W.; Steinbeck, John

    1992-01-01

    High quality YBa2Cu3O(7-x) films were grown in-situ on LaAlO3 (100) by a novel single liquid source plasma-enhanced metalorganic chemical vapor deposition process. The metalorganic complexes M(thd) (sub n), (thd = 2,2,6,6-tetramethyl-3,5-heptanedionate; M = Y, Ba, Cu) were dissolved in an organic solution and injected into a vaporizer immediately upstream of the reactor inlet. The single liquid source technique dramatically simplifies current CVD processing and can significantly improve the process reproducibility. X-ray diffraction measurements indicated that single phase, highly c-axis oriented YBa2Cu3O(7-x) was formed in-situ at substrate temperature 680 C. The as-deposited films exhibited a mirror-like surface, had transition temperature T(sub cO) approximately equal to 89 K, Delta T(sub c) less than 1 K, and Jc (77 K) = 10(exp 6) A/sq cm.

  8. Single liquid source plasma-enhanced metalorganic chemical vapor deposition of high-quality YBa2Cu3O(7-x) thin films

    Science.gov (United States)

    Zhang, Jiming; Gardiner, Robin A.; Kirlin, Peter S.; Boerstler, Robert W.; Steinbeck, John

    1992-12-01

    High quality YBa2Cu3O(7-x) films were grown in-situ on LaAlO3 (100) by a novel single liquid source plasma-enhanced metalorganic chemical vapor deposition process. The metalorganic complexes M(thd) (sub n), (thd = 2,2,6,6-tetramethyl-3,5-heptanedionate; M = Y, Ba, Cu) were dissolved in an organic solution and injected into a vaporizer immediately upstream of the reactor inlet. The single liquid source technique dramatically simplifies current CVD processing and can significantly improve the process reproducibility. X-ray diffraction measurements indicated that single phase, highly c-axis oriented YBa2Cu3O(7-x) was formed in-situ at substrate temperature 680 C. The as-deposited films exhibited a mirror-like surface, had transition temperature T(sub cO) approximately equal to 89 K, Delta T(sub c) less than 1 K, and Jc (77 K) = 10(exp 6) A/sq cm.

  9. Metalorganic chemical vapor deposition of iron disulfide and its use for solar energy conversion

    Science.gov (United States)

    Ennaoui, Ahmed; Fiechter, Sebastian; Vogel, Ralf; Giersig, M.; Weller, Horst; Tributsch, Helmut

    1992-12-01

    Thin polycrystalline films of iron disulfide have been grown on different substrates by chemical vapour deposition. The films were characterized using optical absorption and TEM. RBS and EDAX analysis has been used to explore the chemical stoichiometry. XRD and FTIR allowed the identification of both FeS2 phases pyrite and marcasite. A novel method for sensitization of highly porous Ti02 elecrodes with ultra thin (10-20 nm) polycrystalline films of FeS2 (pyrite) is presented. Photoelectrochemical solar cell using the above electrode generated high photovoltage of up to 600mV compared with single crystalline electrode (200 mV). In this device the semiconductor with a small band gap and high absorption coefficient (FeS2 pyrite; EG = 0.9 eV; a = 6 x 105 cm-1) absorbs the light and injects electrons into the conduction band the wide band gap semiconductor (Ti02 anatase; EG = 3.2 eV). Regeneration of holes is taking place by electron transfer from redox system in the electrolyte.

  10. Isobaric (vapour + liquid) equilibria for the binary system of glycidyl butyrate (1) and epichlorohydrin (2) at (100, 88.66, and 56) kPa

    International Nuclear Information System (INIS)

    Huang Qiang; Meng Qingyi; Ban Chunlan; Zhang Rui; Gao Yingyu

    2012-01-01

    Highlights: ► Isothermal VLE data for system glycidyl butyrate and epichlorohydrin at (100, 88.66, and 56) kPa. ► The ARD of calculated and experimental temperature were all lower than 0.99%. ► The RMSDs of vapour phase y 1 and were all lower than 0.0099. ► The thermodynamics consistency needs are calculated according to Herrington’s check. - Abstract: The (vapour + liquid) equilibria (VLE) data for the binary system of glycidyl butyrate (1) and epichlorohydrin (2) was studied at (100, 88.66, and 56) kPa. Azeotropic behaviour has not been found in this work. The activity coefficients were obtained by the non-linear least squares method based on minimization from the equilibrium data. Average relative deviations between calculated values and the experimental data of temperature are all lower than 0.99% for the three models at the three different pressures investigated. The root mean square deviations (RMSD) of gas phase compositions y 1 and temperatures are all lower than 0.0099 and 1.1 K for 100 kPa, 0.0094 and 4.5 K for 88.66 kPa and 0.0095 and 3.7 K for 56 kPa. The thermodynamic consistency of the calculated data is checked by the Herrington method. The experimental VLE data are compared with the correlated values obtained by means of the NRTL, UNIQUAC, and Wilson models.

  11. Metal-organic frameworks for analytical chemistry: from sample collection to chromatographic separation.

    Science.gov (United States)

    Gu, Zhi-Yuan; Yang, Cheng-Xiong; Chang, Na; Yan, Xiu-Ping

    2012-05-15

    In modern analytical chemistry researchers pursue novel materials to meet analytical challenges such as improvements in sensitivity, selectivity, and detection limit. Metal-organic frameworks (MOFs) are an emerging class of microporous materials, and their unusual properties such as high surface area, good thermal stability, uniform structured nanoscale cavities, and the availability of in-pore functionality and outer-surface modification are attractive for diverse analytical applications. This Account summarizes our research on the analytical applications of MOFs ranging from sampling to chromatographic separation. MOFs have been either directly used or engineered to meet the demands of various analytical applications. Bulk MOFs with microsized crystals are convenient sorbents for direct application to in-field sampling and solid-phase extraction. Quartz tubes packed with MOF-5 have shown excellent stability, adsorption efficiency, and reproducibility for in-field sampling and trapping of atmospheric formaldehyde. The 2D copper(II) isonicotinate packed microcolumn has demonstrated large enhancement factors and good shape- and size-selectivity when applied to on-line solid-phase extraction of polycyclic aromatic hydrocarbons in water samples. We have explored the molecular sieving effect of MOFs for the efficient enrichment of peptides with simultaneous exclusion of proteins from biological fluids. These results show promise for the future of MOFs in peptidomics research. Moreover, nanosized MOFs and engineered thin films of MOFs are promising materials as novel coatings for solid-phase microextraction. We have developed an in situ hydrothermal growth approach to fabricate thin films of MOF-199 on etched stainless steel wire for solid-phase microextraction of volatile benzene homologues with large enhancement factors and wide linearity. Their high thermal stability and easy-to-engineer nanocrystals make MOFs attractive as new stationary phases to fabricate MOF

  12. Leidenfrost vapour layer moderation of the drag crisis and trajectories of superhydrophobic and hydrophilic spheres falling in water

    KAUST Repository

    Vakarelski, Ivan Uriev

    2014-01-01

    We investigate the dynamic effects of a Leidenfrost vapour layer sustained on the surface of heated steel spheres during free fall in water. We find that a stable vapour layer sustained on the textured superhydrophobic surface of spheres falling through 95 °C water can reduce the hydrodynamic drag by up to 75% and stabilize the sphere trajectory for the Reynolds number between 104 and 106, spanning the drag crisis in the absence of the vapour layer. For hydrophilic spheres under the same conditions, the transition to drag reduction and trajectory stability occurs abruptly at a temperature different from the static Leidenfrost point. The observed drag reduction effects are attributed to the disruption of the viscous boundary layer by the vapour layer whose thickness depends on the water temperature. Both the drag reduction and the trajectory stabilization effects are expected to have significant implications for development of sustainable vapour layer based technologies. © the Partner Organisations 2014.

  13. Leidenfrost vapour layer moderation of the drag crisis and trajectories of superhydrophobic and hydrophilic spheres falling in water.

    Science.gov (United States)

    Vakarelski, Ivan U; Chan, Derek Y C; Thoroddsen, Sigurdur T

    2014-08-21

    We investigate the dynamic effects of a Leidenfrost vapour layer sustained on the surface of heated steel spheres during free fall in water. We find that a stable vapour layer sustained on the textured superhydrophobic surface of spheres falling through 95 °C water can reduce the hydrodynamic drag by up to 75% and stabilize the sphere trajectory for the Reynolds number between 10(4) and 10(6), spanning the drag crisis in the absence of the vapour layer. For hydrophilic spheres under the same conditions, the transition to drag reduction and trajectory stability occurs abruptly at a temperature different from the static Leidenfrost point. The observed drag reduction effects are attributed to the disruption of the viscous boundary layer by the vapour layer whose thickness depends on the water temperature. Both the drag reduction and the trajectory stabilization effects are expected to have significant implications for development of sustainable vapour layer based technologies.

  14. A review on the recent development of solar absorption and vapour compression based hybrid air conditioning with low temperature storage

    Directory of Open Access Journals (Sweden)

    Noor D. N.

    2016-01-01

    Full Text Available Conventional air conditioners or vapour compression systems are main contributors to energy consumption in modern buildings. There are common environmental issues emanating from vapour compression system such as greenhouse gas emission and heat wastage. These problems can be reduced by adaptation of solar energy components to vapour compression system. However, intermittence input of daily solar radiation was the main issue of solar energy system. This paper presents the recent studies on hybrid air conditioning system. In addition, the basic vapour compression system and components involved in the solar air conditioning system are discussed. Introduction of low temperature storage can be an interactive solution and improved economically which portray different modes of operating strategies. Yet, very few studies have examined on optimal operating strategies of the hybrid system. Finally, the findings of this review will help suggest optimization of solar absorption and vapour compression based hybrid air conditioning system for future work while considering both economic and environmental factors.

  15. Preparation of SrIrO{sub 3} thin films by using metal-organic aerosol deposition technique

    Energy Technology Data Exchange (ETDEWEB)

    Esser, Sebastian; Schneider, Melanie; Moshnyaga, Vasily; Gegenwart, Philipp [1. Physikalisches Institut, Georg-August-Universitaet Goettingen (Germany)

    2013-07-01

    The interplay between spin-orbit coupling and electronic correlations could lead to interesting novel states in iridium oxide materials. We focus on the perovskite phase of SrIrO{sub 3} because Moon et al. [1] showed by using optical spectroscopy and first-principles calculations that the last member of the Ruddlesden-Popper series Sr{sub n+1}Ir{sub n}O{sub 3n+1} (n = ∞) is close to the Mott transition. By using metal-organic aerosol deposition technique we have grown SrIrO{sub 3} thin films on (111)-oriented SrTiO{sub 3} substrates. The cubic symmetry of the SrTiO{sub 3} substrate ensured that the SrIrO{sub 3} thin film grew in the monoclinic perovskite phase. The X-ray diffraction results suggest that SrIrO{sub 3} thin films in perovskite structure were obtained and these show out of plane epitaxy with monoclinic (002){sub m}-orientation. The temperature dependence of the electrical resistivity of these SrIrO{sub 3} thin films were investigated and metallic behavior was observed down to 50 K.

  16. Metal-organic frameworks as selectivity regulators for hydrogenation reactions.

    Science.gov (United States)

    Zhao, Meiting; Yuan, Kuo; Wang, Yun; Li, Guodong; Guo, Jun; Gu, Lin; Hu, Wenping; Zhao, Huijun; Tang, Zhiyong

    2016-11-03

    Owing to the limited availability of natural sources, the widespread demand of the flavouring, perfume and pharmaceutical industries for unsaturated alcohols is met by producing them from α,β-unsaturated aldehydes, through the selective hydrogenation of the carbon-oxygen group (in preference to the carbon-carbon group). However, developing effective catalysts for this transformation is challenging, because hydrogenation of the carbon-carbon group is thermodynamically favoured. This difficulty is particularly relevant for one major category of heterogeneous catalyst: metal nanoparticles supported on metal oxides. These systems are generally incapable of significantly enhancing the selectivity towards thermodynamically unfavoured reactions, because only the edges of nanoparticles that are in direct contact with the metal-oxide support possess selective catalytic properties; most of the exposed nanoparticle surfaces do not. This has inspired the use of metal-organic frameworks (MOFs) to encapsulate metal nanoparticles within their layers or inside their channels, to influence the activity of the entire nanoparticle surface while maintaining efficient reactant and product transport owing to the porous nature of the material. Here we show that MOFs can also serve as effective selectivity regulators for the hydrogenation of α,β-unsaturated aldehydes. Sandwiching platinum nanoparticles between an inner core and an outer shell composed of an MOF with metal nodes of Fe 3+ , Cr 3+ or both (known as MIL-101; refs 19, 20, 21) results in stable catalysts that convert a range of α,β-unsaturated aldehydes with high efficiency and with significantly enhanced selectivity towards unsaturated alcohols. Calculations reveal that preferential interaction of MOF metal sites with the carbon-oxygen rather than the carbon-carbon group renders hydrogenation of the former by the embedded platinum nanoparticles a thermodynamically favoured reaction. We anticipate that our basic design

  17. Metal-organic frameworks based membranes for liquid separation.

    Science.gov (United States)

    Li, Xin; Liu, Yuxin; Wang, Jing; Gascon, Jorge; Li, Jiansheng; Van der Bruggen, Bart

    2017-11-27

    Metal-organic frameworks (MOFs) represent a fascinating class of solid crystalline materials which can be self-assembled in a straightforward manner by the coordination of metal ions or clusters with organic ligands. Owing to their intrinsic porous characteristics, unique chemical versatility and abundant functionalities, MOFs have received substantial attention for diverse industrial applications, including membrane separation. Exciting research activities ranging from fabrication strategies to separation applications of MOF-based membranes have appeared. Inspired by the marvelous achievements of MOF-based membranes in gas separations, liquid separations are also being explored for the purpose of constructing continuous MOFs membranes or MOF-based mixed matrix membranes. Although these are in an emerging stage of vigorous development, most efforts are directed towards improving the liquid separation efficiency with well-designed MOF-based membranes. Therefore, as an increasing trend in membrane separation, the field of MOF-based membranes for liquid separation is highlighted in this review. The criteria for judicious selection of MOFs in fabricating MOF-based membranes are given. Special attention is paid to rational design strategies for MOF-based membranes, along with the latest application progress in the area of liquid separations, such as pervaporation, water treatment, and organic solvent nanofiltration. Moreover, some attractive dual-function applications of MOF-based membranes in the removal of micropollutants, degradation, and antibacterial activity are also reviewed. Finally, we define the remaining challenges and future opportunities in this field. This Tutorial Review provides an overview and outlook for MOF-based membranes for liquid separations. Further development of MOF-based membranes for liquid separation must consider the demands of strict separation standards and environmental safety for industrial application.

  18. Anisotropic thermal expansion in a metal-organic framework.

    Science.gov (United States)

    Madsen, Solveig Røgild; Lock, Nina; Overgaard, Jacob; Iversen, Bo Brummerstedt

    2014-06-01

    Ionothermal reaction between Mn(II)(acetate)2·4H2O and 1,3,5-benzenetricarboxylic acid (H3BTC) in either of the two ionic liquids 1-ethyl-3-methylimidazolium bromide (EMIMBr) and 1-ethyl-3-methylimidazolium tosylate (EMIMOTs) resulted in the formation of the new metal-organic framework (MOF) EMIM[Mn(II)BTC] (BTC = 1,3,5-benzenetricarboxylate). The compound crystallizes in the orthorhombic space group Pbca with unit-cell parameters of a = 14.66658 (12), b = 12.39497 (9), c = 16.63509 (14) Å at 100 K. Multi-temperature single-crystal (15-340 K) and powder X-ray diffraction studies (100-400 K) reveal strongly anisotropic thermal expansion properties. The linear thermal expansion coefficients, αL(l), attain maximum values at 400 K along the a- and b-axis, with αL(a) = 115 × 10(-6) K(-1) and αL(b) = 75 × 10(-6) K(-1). At 400 K a negative thermal expansion coefficient of -40 × 10(-6) K(-1) is observed along the c-axis. The thermal expansion is coupled to a continuous deformation of the framework, which causes the structure to expand in two directions. Due to the rigidity of the linker, the expansion in the ab plane causes the network to contract along the c-axis. Hirshfeld surface analysis has been used to describe the interaction between the framework structure and the EMIM cation that resides within the channel. This reveals a number of rather weak interactions and one governing hydrogen-bonding interactions.

  19. Open metal-organic framework containing cuprate chains.

    Science.gov (United States)

    Tran, Dat T; Fan, Xiaojuan; Brennan, Daniel P; Zavalij, Peter Y; Oliver, Scott R J

    2005-09-05

    A three-dimensional Cu(II) metal-organic framework, copper hydroxide p-pyridinecarboxylate hydrate, [Cu(OH)(C5H4NCO2).H2O], was synthesized by hydrothermally reacting copper nitrate with p-pyridinecarboxylic acid. The crystals were suitable for single-crystal X-ray diffraction analysis, which showed that the Cu(II) centers adopt a slightly distorted square pyramidal geometry. They coordinate to both the pyridyl and carboxylate functionalities of the pyridinecarboxylate bridging ligands. Infinite copper oxide chains run through the structure and are connected by p-pyridinecarboxylate (p-PyC) ligands. Crystal data: monoclinic, space group P2(1)/n, a = 3.5521(2) A, b = 15.8665(11) A, c = 12.9977(9) A, beta = 95.285(2) degrees , and Z = 4. Thermogravimetric analysis (TGA) revealed that the guest H2O molecules in the channels may be removed, and the material is stable to ca. 245 degrees C. Magnetic measurements indicated the material has one-dimensional (1D) antiferromagnetic ordering within the Cu2+ chains with a Néel temperature of ca. 51 K. Data fitting to the Bonner-Fisher model yielded a coupling constant, J, of -7.3 cm(-1) and g factor of 2.15. The Curie tail below 20 K is due to a small amount of paramagnetic impurities, calculated to be approximately 0.2% in concentration. Further characterization of crystallinity and morphology are discussed, including powder X-ray diffraction (PXRD), elemental analysis, and optical microscopy.

  20. Low temperature growth of vanadium pentoxide nanomaterials by chemical vapour deposition using VO(acac){sub 2} as precursor

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Y; Su, Q; Chen, C H; Yu, M L; Han, G J; Wang, G Q; Xin, K; Lan, W; Liu, X Q, E-mail: xqliu@lzu.edu.c [Department of Physics, Lanzhou University, Lanzhou 730000 (China)

    2010-05-12

    Vanadium pentoxide (V{sub 2}O{sub 5}) nanomaterials with various morphologies were prepared by chemical vapour deposition at a relatively low temperature (evaporation temperature of 250 {sup 0}C and growth temperature of 500 {sup 0}C) using vanadyl acetylacetonate (VO(acac){sub 2}) powder as the vanadium precursor. The obtained samples were characterized by scanning electron microscopy, x-ray diffraction, Raman scattering and photoluminescence spectra. The results revealed that the samples including a V{sub 2}O{sub 5} nanocluster film, V{sub 2}O{sub 5} nanowires and V{sub 2}O{sub 5} nanospheres were synthesized at different distances from the source material. For our chemical vapour transport system, we suggested that VO{sub x} vapour and VO(acac){sub 2} vapour existed simultaneously during the growth process, which resulted in different morphologies of V{sub 2}O{sub 5} nanomaterials. The quite different supersaturation distributions of VO{sub x} vapour and VO(acac){sub 2} vapour led to three main growth areas. The V{sub 2}O{sub 5} film was grown in the region where the supersaturation of the VO{sub x} vapour was high, V{sub 2}O{sub 5} nanowires were obtained where the supersaturation of the VO{sub x} vapour was relatively low and V{sub 2}O{sub 5} nanospheres were synthesized in the region where the supersaturation of the VO(acac){sub 2} vapour was high. The growth pressure that influenced the vapour concentration controlled the morphologies of the nanowires. It was found that a specific level of low concentration was necessary to ensure the growth of V{sub 2}O{sub 5} nanowires.

  1. Density profiles and collective excitations of a trapped two-component Fermi vapour

    International Nuclear Information System (INIS)

    Amoruso, M.; Meccoli, I.; Minguzzi, A.; Tosi, M.P.

    1999-08-01

    We discuss the ground state and the small-amplitude excitations of a degenerate vapour of fermionic atoms placed in two hyperfine states inside a spherical harmonic trap. An equations-of-motion approach is set up to discuss the hydrodynamic dissipation processes from the interactions between the two components of the fluid beyond mean-field theory and to emphasize analogies with spin dynamics and spin diffusion in a homogeneous Fermi liquid. The conditions for the establishment of a collisional regime via scattering against cold-atom impurities are analyzed. The equilibrium density profiles are then calculated for a two-component vapour of 40 K atoms: they are little modified by the interactions for presently relevant values of the system parameters, but spatial separation of the two components will spontaneously arise as the number of atoms in the trap is increased. The eigenmodes of collective oscillation in both the total particle number density and the concentration density are evaluated analytically in the special case of a symmetric two-component vapour in the collisional regime. The dispersion relation of the surface modes for the total particle density reduces in this case to that of a one-component Fermi vapour, whereas the frequencies of all other modes are shifted by the interactions. (author)

  2. Water vapour trends at several tropospheric levels over South America between 1973 and 2003

    International Nuclear Information System (INIS)

    Morales, L.; Mattar, C.; Da-Silva, L.; Abarca, R.

    2009-01-01

    In this paper water vapour trends were analyzed at several tropospheric levels over South America between 1973 and 2003. It was carried out using in situ values retrieved by 15 radiosonde stations and NCEP NCAR Reanalysis data (NNR). NNR and radiosonde water vapour data were linked to Koeppen-Geiger climatic zones to calculate anomalies, trends, and the non-parametric statistical significance for each mandatory level. A methodology used to process radiosonde data is shown. Water vapour trends in tropical climates presented positive decadal trends. This is statistically significant for the first mandatory levels retrieved by radiosonde. The highest values are presented in average with NNR; the decadal magnitude for climate Af being 0.15 g kg -1 for 1000 and 925 h Pa, and for climate As 0.27 g kg -1 for 925 and 850 h Pa. For non-tropical climates the magnitude trends of specific humidity are affected by the spatial resolution of NNR, which is seen when comparing the results received by the radiosondes. Finally, this paper shows the initial results of water vapour content trends in the last three decades over South America. Strong climatic events and synoptic oscillations were not commented upon.

  3. The fourth international symposium on inhaled particles and vapours, Edinburgh 22-26 September 1975

    International Nuclear Information System (INIS)

    Bailey, M.R.

    1975-11-01

    A brief account is given of the symposium, organised by the British Occupational Hygiene Society in co-operation with the European Communities. Its objective was to present the results of the latest research into the inhalation and retention of dusts and vapours, the way they are handled by the body, and their effects, with emphasis on the basic mechanisms involved. (author)

  4. Water vapour rises from the cooling towers for the ATLAS detector at Point 1

    CERN Multimedia

    Brice, Maximilien

    2015-01-01

    Electronics on the ATLAS detector produce heat when the experiment is running. An elaborate cooling system keeps the detector from overheating. On the surface, the warm water vapour that rises from the detector 100metres underground is clearly visible from the ATLAS cooling towers on the CERN Meyrin site in Switzerland.

  5. Heat-flux enhancement by vapour-bubble nucleation in Rayleigh-Bénard turbulence

    NARCIS (Netherlands)

    Narezo Guzman, Daniela; Xie, Yanbo; Chen, S.; Fernandez Rivas, David; Sun, Chao; Lohse, Detlef; Ahlers, Günter

    2016-01-01

    We report on the enhancement of turbulent convective heat transport due to vapour-bubble nucleation at the bottom plate of a cylindrical Rayleigh–Bénard sample (aspect ratio 1.00, diameter 8.8 cm) filled with liquid. Microcavities acted as nucleation sites, allowing for well-controlled bubble

  6. Vapour cooling of poorly conducting hot substrates increases the dynamic Leidenfrost temperature

    NARCIS (Netherlands)

    van Limbeek, Michiel Antonius Jacobus; Shirota, Minori; Sleutel, Pascal; Sun, Chao; Prosperetti, Andrea; Lohse, Detlef

    2016-01-01

    A drop impacting a smooth solid surface heated above the saturation temperature can either touch it (contact boiling) or not (film boiling), depending on the surface temperature. The heat transfer is greatly reduced in the latter case by the insulating vapour layer under the drop. In contrast to

  7. Solvents for CO2 capture. Structure-activity relationships combined with vapour-liquid-equilibrium measurements

    NARCIS (Netherlands)

    Mergler, Y.L.; Rumley-Van Gurp, R.; Brasser, P.; Koning, M.C. de; Goetheer, E.L.V.

    2011-01-01

    In this study a systematic approach was chosen to test and characterize amine systems for CO2 capture. Vapour-liquid-equilibrium measurements were performed on a homologue series of amines, with ethylene amine as base structure. Various functional groups were used that ranged in chemical and

  8. Control of tin oxide film morphology by addition of hydrocarbons to the chemical vapour deposition process

    Czech Academy of Sciences Publication Activity Database

    Yates, H.M.; Evans, P.; Sheel, D.W.; Remeš, Zdeněk; Vaněček, Milan

    2010-01-01

    Roč. 519, č. 4 (2010), s. 1334-1340 ISSN 0040-6090 EU Projects: European Commission(XE) 214134 - N2P; European Commission(XE) 38885 - SE-POWERFOIL Institutional research plan: CEZ:AV0Z10100521 Keywords : alcohol * chemical vapour deposition * morphology * tin oxide Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 1.909, year: 2010

  9. Chemical vapour generation of silver: reduced palladium as permanent reaction modifier for enhanced performance

    Czech Academy of Sciences Publication Activity Database

    Matoušek, Tomáš; Sturgeon, R. E.

    2004-01-01

    Roč. 19, č. 8 (2004), s. 1014-1017 ISSN 0267-9477 R&D Projects: GA ČR GA203/01/0453 Institutional research plan: CEZ:AV0Z4031919 Keywords : chemical vapour generation * chemical modification * silver Subject RIV: CB - Analytical Chemistry, Separation Impact factor: 3.926, year: 2004

  10. The pyrolytic decomposition of ATSB during chemical vapour deposition of thin alumina films

    NARCIS (Netherlands)

    Haanappel, V.A.C.; Haanappel, V.A.C.; van Corbach, H.D.; Fransen, T.; Gellings, P.J.

    1994-01-01

    The effect of the deposition temperature and the partial pressure of water on the thermal decomposition chemistry of aluminium-tri-sec-butoxide (ATSB) during metal organic chemical vapour deposition (MOCVD) is reported. The MOCVD experiments were performed in nitrogen at atmospheric pressure. The

  11. Determining the vapour pressures of plant volatiles from gas chromatographic retention data

    Czech Academy of Sciences Publication Activity Database

    Hoskovec, Michal; Grygarová, D.; Cvačka, Josef; Streinz, Ludvík; Zima, J.; Verevkin, S. P.; Koutek, Bohumír

    2005-01-01

    Roč. 1083, - (2005), s. 161-172 ISSN 0021-9673 Institutional research plan: CEZ:AV0Z4055905 Keywords : vapour pressure * thermodinamic parameters * plant volatiles Subject RIV: CC - Organic Chemistry Impact factor: 3.096, year: 2005

  12. On the representativity of water vapour measurements at Boulder for global stratospheric trends

    Science.gov (United States)

    Lossow, S.

    2016-12-01

    Long-term changes of water vapour in the lower stratosphere inevitably affect the surface climate. Thus understanding such changes is of primary importance. The longest continuous data set is based on balloon-borne frost point hygrometer observations at Boulder. Overall this data set shows an increase in water vapour since the 1980s accompanied by large variability on short time scales (Hurst et al., 2011). Recently a merged satellite data set, covering the time period between 1988 and 2010, has been analysed showing a decrease of water vapour in the lower stratosphere (Hegglin et al., 2014). This discrepancy is difficult to reconcile. There might be problems with one data set or even with both. Also the local behaviour at Boulder might not be representative for the zonal mean behaviour, which is represented by the satellite observations. So far this has been assumed and the Boulder changes have even been considered to be globally representative. Here I present investigations of this aspect using both model simulations and observations. References: Hegglin et al. (2014), "Vertical structure of stratospheric water vapour trends derived from merged satellite data", Nature Geoscience, 7, 768 - 776, doi:10.1038/ngeo2236. Hurst et al. (2011), "Stratospheric water vapor trends over Boulder, Colorado: Analysis of the 30 year Boulder record", Journal of Geophysical Research, 116, D02,306, doi:10.1029/2010JD015065.

  13. Surfactant assisted chemical vapour generation of silver for AAS and ICP-OES: a mechanistic study

    Czech Academy of Sciences Publication Activity Database

    Matoušek, Tomáš; Sturgeon, R. E.

    2003-01-01

    Roč. 18, č. 5 (2003), s. 487-494 ISSN 0267-9477 Institutional research plan: CEZ:AV0Z4031919 Keywords : vapour generation * ICP-OES * silver Subject RIV: CB - Analytical Chemistry, Separation Impact factor: 3.200, year: 2003

  14. Expanding thermal plasma chemical vapour deposition of ZnO:Al layers for CIGS solar cells

    NARCIS (Netherlands)

    Sharma, K.; Williams, B.L.; Mittal, A.; Knoops, H.C.M.; Kniknie, B.J.; Bakker, N.J.; Kessels, W.M.M.; Schropp, R.E.I.; Creatore, M.

    2014-01-01

    Aluminium-doped zinc oxide (ZnO:Al) grown by expanding thermal plasma chemical vapour deposition (ETP-CVD) has demonstrated excellent electrical and optical properties, which make it an attractive candidate as a transparent conductive oxide for photovoltaic applications. However, when depositing

  15. Reaction of soda-lime-silica glass melt with water vapour at melting temperatures

    Czech Academy of Sciences Publication Activity Database

    Vernerová, Miroslava; Kloužek, Jaroslav; Němec, Lubomír

    2015-01-01

    Roč. 416, MAY 15 (2015), s. 21-30 ISSN 0022-3093 R&D Projects: GA TA ČR TA01010844 Institutional support: RVO:67985891 Keywords : glass melt * sulfate * water vapour * bubble nucleation * melt foaming * glass melting Subject RIV: JH - Ceramics, Fire-Resistant Materials and Glass Impact factor: 1.825, year: 2015

  16. The effect of air permeability of chemical protective clothing material on clothing vapour resistance

    NARCIS (Netherlands)

    Havenith, G.; Vuister, R.; Wammes, L.

    1996-01-01

    One of the major problems associated with Chemical Warfare Protective Clothing (CW) is the additional heat load created by the garments. For CW-overgarments, research in the direction of reducing material thickness and thus heat and vapour resistance have not resulted in major improvements. The

  17. ArF Laser -Induced Chemical Vapour Deposition of Polythiene Films from Carbon Disulfide

    Czech Academy of Sciences Publication Activity Database

    Tomovska, R.; Bastl, Zdeněk; Vorlíček, Vladimír; Vacek, Karel; Šubrt, Jan; Plzák, Zbyněk; Pola, Josef

    2003-01-01

    Roč. 107, č. 36 (2003), s. 9793-9801 ISSN 1089-5647 R&D Projects: GA MŠk ME 612 Institutional research plan: CEZ:AV0Z4032918; CEZ:AV0Z4040901 Keywords : laser photolysis * ArF * chemical vapour deposition Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 3.679, year: 2003

  18. Vapour Removal from the Greenhouse Using Forced Ventilation when Applying a Thermal Screen

    NARCIS (Netherlands)

    Campen, J.B.

    2008-01-01

    The objective of this study is to dimension a system capable of removing water vapour mainly generated by evaporation of the crop when a thermal screen is applied. The humid greenhouse air is replaced by cold dry outside air using an air distribution system. The dry air is injected above the

  19. Utility of DMSP-SSM/I for integrated water vapour over the Indian seas

    Indian Academy of Sciences (India)

    ... these algorithms is compared with that derived from radiosonde observations at Minicoy and Port Blair islands. Algorithm-3 of Schlussel and Emery (1990) performed best. On the basis of this algorithm, distribution of integrated water vapour is determined during the monsoon depression (22nd{27th July, 1992) that formed ...

  20. Validation of stratospheric water vapour measurements from the airborne microwave radiometer AMSOS

    Directory of Open Access Journals (Sweden)

    S. C. Müller

    2008-06-01

    Full Text Available We present the validation of a water vapour dataset obtained by the Airborne Microwave Stratospheric Observing System AMSOS, a passive microwave radiometer operating at 183 GHz. Vertical profiles are retrieved from spectra by an optimal estimation method. The useful vertical range lies in the upper troposphere up to the mesosphere with an altitude resolution of 8 to 16 km and a horizontal resolution of about 57 km. Flight campaigns were performed once a year from 1998 to 2006 measuring the latitudinal distribution of water vapour from the tropics to the polar regions. The obtained profiles show clearly the main features of stratospheric water vapour in all latitudinal regions. Data are validated against a set of instruments comprising satellite, ground-based, airborne remote sensing and in-situ instruments. It appears that AMSOS profiles have a dry bias of 0 to –20%, when compared to satellite experiments. Also a comparison between AMSOS and in-situ hygrosondes FISH and FLASH have been performed. A matching in the short overlap region in the upper troposphere of the lidar measurements from the DIAL instrument and the AMSOS dataset allowed water vapour profiling from the middle troposphere up to the mesosphere.

  1. Ethanol vapour sensing properties of screen printed WO3 thick films

    Indian Academy of Sciences (India)

    TECS

    have been used to develop varistors, sensors and actua- tors (Prudenziati 1994). The thick film gas sensors based ... sively studied gases in the thick film gas sensors. The detection of ethanol vapour based on thin film of SnO2. (Mishra et ... The organic vehicles such as butyl carbitol acetate (BCA) and ethyl cellulose were.

  2. An Investigation of Tertiary Students' Understanding of Evaporation, Condensation and Vapour Pressure. Research Report

    Science.gov (United States)

    Gopal, Hemant; Kleinsmidt, Jacques; Case, Jennifer; Musonge, Paul

    2004-01-01

    Based on a purposive sample of 15 second-year chemical engineering students, this study investigates students' conceptions of evaporation, condensation and vapour pressure. During individual interviews the students were questioned on three tasks that had been designed around these topics. Qualitative analysis of student responses showed a range of…

  3. An Investigation of Tertiary Students' Understanding of Evaporation, Condensation and Vapour Pressure

    Science.gov (United States)

    Gopal, Hemant; Kleinsmidt, Jacques; Case, Jennifer; Musonge, Paul

    2004-01-01

    Based on a purposive sample of 15 second-year chemical engineering students, this study investigates students' conceptions of evaporation, condensation and vapour pressure. During individual interviews the students were questioned on three tasks that had been designed around these topics. Qualitative analysis of student responses showed a range of…

  4. High-pressure (vapour + liquid) equilibria for ternary systems composed by {(E)-2-hexenal or hexanal + carbon dioxide + water}: Partition coefficient measurement

    International Nuclear Information System (INIS)

    Bejarano, Arturo; López, Pablo I.; Valle, José M. del; Fuente, Juan C. de la

    2015-01-01

    Highlights: • A new apparatus based on a static–analytic method was assembled in this work. • This work reports high-pressure VLE data of (E)-2-hexenal or hexanal + CO 2 + water. • Data includes (CO 2 + water) partition coefficients of (E)-2-hexenal and hexanal. • High separation factors from water (∼10 4 ) were found especially for (E)-2-hexenal. • The data were obtained at T = (313, 323, and 333) K and pressures from (8 to 19) MPa. - Abstract: A new apparatus based on a static–analytic method assembled in this work was utilised to perform high-pressure (vapour + liquid) equilibria measurements of aqueous ternary systems. This work includes values of isothermal partition coefficients between CO 2 and water of two apple aroma constituents, (E)-2-hexenal and hexanal. Additionally, this work reports new experimental (vapour + liquid) equilibria measurements for the ternary systems (CO 2 + (E)-2-hexenal + water) and (CO 2 + hexanal + water), at fixed liquid phase composition (600 mg · kg −1 ), at temperatures of (313, 323 and 333) K and at pressures from (8 to 19) MPa. Vapour liquid interphase was checked and monitored visually for all the systems studied in this work. No liquid immiscibility was observed at the composition, temperatures and pressures studied. In order to suggest reasonable operation conditions for fractionation of aromas with dense carbon dioxide, partition coefficients of the aroma compounds between CO 2 and water along with their separation factors from water were calculated. Partition coefficients of (E)-2-hexenal between CO 2 and water were in the range of (6 to 91) and where found to be near six times higher than those of hexanal (9 to 17). Very high separation factors from water were observed (∼10 4 ) especially for (E)-2-hexenal. The highest separation factor, for both compounds, was found at a temperature of 313 K and pressures from (12 to 14) MPa

  5. Luminescent metal-organic framework-functionalized graphene oxide nanocomposites and the reversible detection of high explosives

    Science.gov (United States)

    Lee, Ji Ha; Jaworski, Justyn; Jung, Jong Hwa

    2013-08-01

    Achieving both high specificity and sensitivity are essential for gas phase chemical detection systems. Recent implementation of Metal-Organic Frameworks (MOFs) have shown great success in separation and storage systems for specific gas molecules. By implementing a MOF structure comprised of Zn2+ coordinated trans-stilbene derivatives, a gas responsive material has been created which exhibits a high photoluminescence quantum yield, offering new opportunities for chemical sensors. Here, we reveal a nanocomposite material, assembled from azobenzene functionalized graphene oxide and stilbene-MOF, that is capable of luminescent quenching by explosive gases. This unique system displays selectivity to dinitrotoluene (71% quenching) over trinitrotoluene (20% quenching) with sub ppm sensitivity and response times of less than a minute. We show that this implementation of a graphene-based MOF composite provides a unique strategy in the development of molecularly well-defined materials having rapid, reversible, and gas selective fluorescent quenching capabilities. This opens the way for new advances in the assembly of low density frameworks using isomerization suppressed materials.Achieving both high specificity and sensitivity are essential for gas phase chemical detection systems. Recent implementation of Metal-Organic Frameworks (MOFs) have shown great success in separation and storage systems for specific gas molecules. By implementing a MOF structure comprised of Zn2+ coordinated trans-stilbene derivatives, a gas responsive material has been created which exhibits a high photoluminescence quantum yield, offering new opportunities for chemical sensors. Here, we reveal a nanocomposite material, assembled from azobenzene functionalized graphene oxide and stilbene-MOF, that is capable of luminescent quenching by explosive gases. This unique system displays selectivity to dinitrotoluene (71% quenching) over trinitrotoluene (20% quenching) with sub ppm sensitivity and

  6. Separation of polar compounds using a flexible metal-organic framework

    NARCIS (Netherlands)

    Motkuri, R.K.; Thallapally, P.K.; Annapureddy, H.V.R.; Dang, L.X.; Krishna, R.; Nune, S.K.; Fernandez, C.A.; Liu, J.; McGrail, B.P.

    2015-01-01

    A flexible metal-organic framework constructed from a flexible linker is shown to possess the capability of separating mixtures of polar compounds (propanol isomers) by exploiting the differences in the saturation capacities of the constituents. Transient breakthrough simulations show that these

  7. From metal-organic squares to porous zeolite-like supramolecular assemblies

    KAUST Repository

    Wang, Shuang

    2010-12-29

    We report the synthesis, structure, and characterization of two novel porous zeolite-like supramolecular assemblies, ZSA-1 and ZSA-2, having zeolite gis and rho topologies, respectively. The two compounds were assembled from functional metal-organic squares (MOSs) via directional hydrogen-bonding interactions and exhibited permanent microporosity and thermal stability up to 300 °C. © 2010 American Chemical Society.

  8. In silico screening of metal-organic frameworks in separation applications

    NARCIS (Netherlands)

    Krishna, R.; van Baten, J.M.

    2011-01-01

    Porous materials such as metal-organic frameworks (MOFs) and zeolitic imidazolate frameworks (ZIFs) offer considerable potential for separating a variety of mixtures such as those relevant for CO2 capture (CO2/H2, CO2/CH4, CO2/N2), CH4/H2, alkanes/alkenes, and hydrocarbon isomers. There are

  9. Assembly of a water-insoluble strontium metal-organic framework with luminescent properties

    Czech Academy of Sciences Publication Activity Database

    Lo, S.-H.; Liu, H.-K.; Zhan, J.-X.; Lin, W.-Ch.; Kao, Ch.-Ch.; Lin, Ch.-H.; Zima, Vítězslav

    2011-01-01

    Roč. 14, č. 10 (2011), 1602-1605 ISSN 1387-7003 R&D Projects: GA ČR GA203/08/0208 Institutional research plan: CEZ:AV0Z40500505 Keywords : structure * strontium * metal-organic Subject RIV: CA - Inorganic Chemistry Impact factor: 1.972, year: 2011

  10. Surface functionalization of metal-organic polyhedron for homogeneous cyclopropanation catalysis.

    Science.gov (United States)

    Lu, Weigang; Yuan, Daqiang; Yakovenko, Andrey; Zhou, Hong-Cai

    2011-05-07

    A super-paddlewheel (comprised of two paddlewheels) metal-organic polyhedron (MOP) containing surface hydroxyl groups was synthesized and characterized. Condensation reactions with linear alkyl anhydrides lead to new MOPs with enhanced solubility. As a result, the surface-modified MOP 4 was demonstrated as a homogeneous Lewis-acid catalyst. © The Royal Society of Chemistry 2011

  11. Metal-organic framework catalysts for selective cleavage of aryl-ether bonds

    Science.gov (United States)

    Allendorf, Mark D.; Stavila, Vitalie

    2017-08-01

    The present invention relates to methods of employing a metal-organic framework (MOF) as a catalyst for cleaving chemical bonds. In particular instances, the MOF results in selective bond cleavage that results in hydrogenolyzis. Furthermore, the MOF catalyst can be reused in multiple cycles. Such MOF-based catalysts can be useful, e.g., to convert biomass components.

  12. Bridging-ligand-substitution strategy for the preparation of metal-organic polyhedra

    Science.gov (United States)

    Li, Jian-Rong; Zhou, Hong-Cai

    2010-10-01

    Metal-organic polyhedra-discrete molecular architectures constructed through the coordination of metal ions and organic linkers-have recently attracted considerable attention due to their intriguing structures, their potential for a variety of applications and their relevance to biological self-assembly. Several synthetic routes have been investigated to prepare these complexes. However, to date, these preparative methods have typically been based on the direct assembly of metal ions and organic linkers. Although these routes are convenient, it remains difficult to find suitable reaction conditions or to control the outcome of the assembly process. Here, we demonstrate a synthetic strategy based on the substitution of bridging ligands in soluble metal-organic polyhedra. The introduction of linkers with different properties from those of the initial metal-organic polyhedra can thus lead to new metal-organic polyhedra with distinct properties (including size and shape). Furthermore, partial substitution can also occur and form mixed-ligand species that may be difficult to access by means of other approaches.

  13. Channeling and electromagnetic radiation of relativistic charged particles in metal-organic frameworks

    Science.gov (United States)

    Zhevago, N. K.; Glebov, V. I.

    2017-06-01

    We have developed the theory of electromagnetic interaction of relativistic charged particles with metal-organic frameworks (MOFs). The electrostatic potential and electron number density distribution in MOFs were calculated using the most accurate data for the atomic form factors. Peculiarities of axial channeling of fast charged particles and various types of electromagnetic radiation from relativistic particles has been discussed.

  14. Synthesis, characterization and sorption properties of zinc(II) metal-organic framework containing methanetetrabenzoate ligand

    Czech Academy of Sciences Publication Activity Database

    Almáši, M.; Zeleňák, V.; Gyepes, R.; Zukal, Arnošt; Čejka, Jiří

    2013-01-01

    Roč. 437, SI (2013), s. 101-107 ISSN 0927-7757 R&D Projects: GA ČR GA203/08/0604 Institutional support: RVO:61388955 Keywords : Metal-organic framework * Zinc * Methanetetrabenzoate Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 2.354, year: 2013

  15. Microporous metal-organic framework with potential for carbon dioxide capture at ambient conditions

    NARCIS (Netherlands)

    Xiang, S.C.; He, Y.; Zhang, Z.; Wu, H.; Zhou, W.; Krishna, R.; Chen, B.

    2012-01-01

    Carbon dioxide capture and separation are important industrial processes that allow the use of carbon dioxide for the production of a range of chemical products and materials, and to minimize the effects of carbon dioxide emission. Porous metal-organic frameworks are promising materials to achieve

  16. Removal of chlorine gas by an amine functionalized metal-organic framework via electrophilic aromatic substitution.

    Science.gov (United States)

    DeCoste, Jared B; Browe, Matthew A; Wagner, George W; Rossin, Joseph A; Peterson, Gregory W

    2015-08-11

    Here we report the removal of chlorine gas from air via a reaction with an amine functionalized metal-organic framework (MOF). It is found that UiO-66-NH2 has the ability to remove 1.24 g of Cl2 per g of MOF via an electrophilic aromatic substitution reaction producing HCl, which is subsequently neutralized by the MOF.

  17. Anthraquinone with Tailored Structure for Nonaqueous Metal-Organic Redox Flow Battery

    Energy Technology Data Exchange (ETDEWEB)

    Wang, Wei; Xu, Wu; Cosimbescu, Lelia; Choi, Daiwon; Li, Liyu; Yang, Zhenguo

    2012-06-08

    A nonaqueous, hybrid metal-organic redox flow battery based on tailored anthraquinone structure is demonstrated to have an energy efficiency of {approx}82% and a specific discharge energy density similar to aqueous redox flow batteries, which is due to the significantly improved solubility of anthraquinone in supporting electrolytes.

  18. Heme-Containing Metal-Organic Frameworks for the Oxidative Degradation of Chemical Warfare Agents

    Science.gov (United States)

    2016-04-14

    P.O. Box 12211 Research Triangle Park, NC 27709-2211 metal-organic frameworks, catalysis , metalloporphyrins, oxidation chemistry REPORT DOCUMENTATION...respectively; hydrogen atoms are omitted for clarity. ARO Final Progress Report...red, gray, bright green, and dark green represent Fe, N, O, C, F, and Cl respectively; hydrogen atoms omitted from clarity. Right: Diffuse

  19. Methodologies for evaluation of metal-organic frameworks in separation applications

    NARCIS (Netherlands)

    Krishna, R.

    2015-01-01

    Metal-organic frameworks (MOFs) offer considerable potential for separating a wide variety of mixtures. For any given separation, there are several MOFs that could be employed. Therefore, there is a need for reliable procedures for screening and ranking MOFs with regard to their anticipated

  20. Metal-Organic Frameworks For Adsorption Driven Energy Transformation : From Fundamentals To Applications

    NARCIS (Netherlands)

    De Lange, M.F.

    2015-01-01

    A novel class of materials, i.e. Metal-Organic Frameworks (MOFs), has successfully been developed that is extremely suited for application in heat pumps and chillers. They have a superior performance over commercial sorbents and may potentially contribute to considerable energy savings worldwide.