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Sample records for sublimation gibbs energies

  1. Vapor pressures and standard molar enthalpies, entropies and Gibbs energies of sublimation of two hexachloro herbicides using a TG unit

    International Nuclear Information System (INIS)

    Vecchio, Stefano

    2010-01-01

    The vapor pressures above the solid hexachlorobenzene (HCB) and above both the solid and liquid 1,2,3,4,5,6-hexachlorocyclohexane (lindane) were determined in the ranges 332-450 K and 347-429 K, respectively, by measuring the mass loss rates recorded by thermogravimetry under both isothermal and nonisothermal conditions. The results obtained were compared with those taken from literature. From the temperature dependence of vapor pressure derived by the experimental thermogravimetry data the molar enthalpies of sublimation Δ cr g H m o ( ) were selected for HCB and lindane as well as the molar enthalpy of vaporization Δ l g H m o ( ) for lindane only, at the middle of the respective temperature intervals. The melting temperatures and the molar enthalpies of fusion Δ cr l H m o (T fus ) of lindane were measured by differential scanning calorimetry. Finally, the standard molar enthalpies of sublimation Δ cr g H m o (298.15 K) were obtained for both chlorinated compounds at the reference temperature of 298.15 K using the Δ cr g H m o ( ), Δ l g H m o ( ) and Δ cr l H m o (T fus ) values, as well as the heat capacity differences between gas and liquid and the heat capacity differences between gas and solid, Δ l g C p,m o and Δ cr g C p,m o , respectively, both estimated by applying a group additivity procedure. Therefore, the averages of the standard (p o = 0.1 MPa) molar enthalpies, entropies and Gibbs energies of sublimation at 298.15 K, have been derived.

  2. Vapor pressures and standard molar enthalpies, entropies, and Gibbs free energies of sublimation of 2,4- and 3,4-dinitrobenzoic acids

    International Nuclear Information System (INIS)

    Vecchio, Stefano; Brunetti, Bruno

    2009-01-01

    The vapor pressures of the solid and liquid 2,4- and 3,4-dinitrobenzoic acids were determined by torsion-effusion and thermogravimetry under both isothermal and non-isothermal conditions, respectively. From the temperature dependence of vapor pressure derived by the experimental torsion-effusion and thermogravimetry data the molar enthalpies of sublimation Δ cr g H m 0 ( ) and vaporization Δ l g H m 0 ( ) were determined, respectively, at the middle of the respective temperature intervals. The melting temperatures and the molar enthalpies of fusion of these compounds were measured by d.s.c. Finally, the results obtained by all the methods proposed were corrected at the reference temperature of 298.15 K using the estimated heat capacity differences between gas and liquid for vaporization experiments and the estimated heat capacity differences between gas and solid for sublimation experiments. Therefore, the averages of the standard (p o = 0.1 MPa) molar enthalpies, entropies and Gibbs free energies of sublimation at 298.15 K, have been derived.

  3. Enzyme Catalysis and the Gibbs Energy

    Science.gov (United States)

    Ault, Addison

    2009-01-01

    Gibbs-energy profiles are often introduced during the first semester of organic chemistry, but are less often presented in connection with enzyme-catalyzed reactions. In this article I show how the Gibbs-energy profile corresponds to the characteristic kinetics of a simple enzyme-catalyzed reaction. (Contains 1 figure and 1 note.)

  4. SUBLIMATION-DRIVEN ACTIVITY IN MAIN-BELT COMET 313P/GIBBS

    Energy Technology Data Exchange (ETDEWEB)

    Hsieh, Henry H. [Institute of Astronomy and Astrophysics, Academia Sinica, P.O. Box 23-141, Taipei 10617, Taiwan (China); Hainaut, Olivier [European Southern Observatory, Karl-Schwarzschild-Straße 2, D-85748 Garching bei München (Germany); Novaković, Bojan [Department of Astronomy, Faculty of Mathematics, University of Belgrade, Studentski trg 16, 11000 Belgrade (Serbia); Bolin, Bryce [Observatoire de la Côte d’Azur, Boulevard de l’Observatoire, B.P. 4229, F-06304 Nice Cedex 4 (France); Denneau, Larry; Haghighipour, Nader; Kleyna, Jan; Meech, Karen J.; Schunova, Eva; Wainscoat, Richard J. [Institute for Astronomy, University of Hawaii, 2680 Woodlawn Drive, Honolulu, HI 96822 (United States); Fitzsimmons, Alan [Astrophysics Research Centre, Queens University Belfast, Belfast BT7 1NN (United Kingdom); Kokotanekova, Rosita; Snodgrass, Colin [Planetary and Space Sciences, Department of Physical Sciences, The Open University, Milton Keynes MK7 6AA (United Kingdom); Lacerda, Pedro [Max Planck Institute for Solar System Research, Justus-von-Liebig-Weg 3, D-37077 Göttingen (Germany); Micheli, Marco [ESA SSA NEO Coordination Centre, Frascati, RM (Italy); Moskovitz, Nick; Wasserman, Lawrence [Lowell Observatory, 1400 W. Mars Hill Road, Flagstaff, AZ 86001 (United States); Waszczak, Adam, E-mail: hhsieh@asiaa.sinica.edu.tw [Division of Geological and Planetary Sciences, California Institute of Technology, Pasadena, CA 91125 (United States)

    2015-02-10

    We present an observational and dynamical study of newly discovered main-belt comet 313P/Gibbs. We find that the object is clearly active both in observations obtained in 2014 and in precovery observations obtained in 2003 by the Sloan Digital Sky Survey, strongly suggesting that its activity is sublimation-driven. This conclusion is supported by a photometric analysis showing an increase in the total brightness of the comet over the 2014 observing period, and dust modeling results showing that the dust emission persists over at least three months during both active periods, where we find start dates for emission no later than 2003 July 24 ± 10 for the 2003 active period and 2014 July 28 ± 10 for the 2014 active period. From serendipitous observations by the Subaru Telescope in 2004 when the object was apparently inactive, we estimate that the nucleus has an absolute R-band magnitude of H{sub R} = 17.1 ± 0.3, corresponding to an effective nucleus radius of r{sub e} ∼ 1.00 ± 0.15 km. The object’s faintness at that time means we cannot rule out the presence of activity, and so this computed radius should be considered an upper limit. We find that 313P’s orbit is intrinsically chaotic, having a Lyapunov time of T{sub l} = 12,000 yr and being located near two three-body mean-motion resonances with Jupiter and Saturn, 11J-1S-5A and 10J+12S-7A, yet appears stable over >50 Myr in an apparent example of stable chaos. We furthermore find that 313P is the second main-belt comet, after P/2012 T1 (PANSTARRS), to belong to the ∼155 Myr old Lixiaohua asteroid family.

  5. Illustrating Enzyme Inhibition Using Gibbs Energy Profiles

    Science.gov (United States)

    Bearne, Stephen L.

    2012-01-01

    Gibbs energy profiles have great utility as teaching and learning tools because they present students with a visual representation of the energy changes that occur during enzyme catalysis. Unfortunately, most textbooks divorce discussions of traditional kinetic topics, such as enzyme inhibition, from discussions of these same topics in terms of…

  6. First-Year University Chemistry Textbooks' Misrepresentation of Gibbs Energy

    Science.gov (United States)

    Quilez, Juan

    2012-01-01

    This study analyzes the misrepresentation of Gibbs energy by college chemistry textbooks. The article reports the way first-year university chemistry textbooks handle the concepts of spontaneity and equilibrium. Problems with terminology are found; confusion arises in the meaning given to [delta]G, [delta][subscript r]G, [delta]G[degrees], and…

  7. Consistent estimation of Gibbs energy using component contributions.

    Directory of Open Access Journals (Sweden)

    Elad Noor

    Full Text Available Standard Gibbs energies of reactions are increasingly being used in metabolic modeling for applying thermodynamic constraints on reaction rates, metabolite concentrations and kinetic parameters. The increasing scope and diversity of metabolic models has led scientists to look for genome-scale solutions that can estimate the standard Gibbs energy of all the reactions in metabolism. Group contribution methods greatly increase coverage, albeit at the price of decreased precision. We present here a way to combine the estimations of group contribution with the more accurate reactant contributions by decomposing each reaction into two parts and applying one of the methods on each of them. This method gives priority to the reactant contributions over group contributions while guaranteeing that all estimations will be consistent, i.e. will not violate the first law of thermodynamics. We show that there is a significant increase in the accuracy of our estimations compared to standard group contribution. Specifically, our cross-validation results show an 80% reduction in the median absolute residual for reactions that can be derived by reactant contributions only. We provide the full framework and source code for deriving estimates of standard reaction Gibbs energy, as well as confidence intervals, and believe this will facilitate the wide use of thermodynamic data for a better understanding of metabolism.

  8. Sublimation thermodynamics of four fluoroquinolone antimicrobial compounds

    International Nuclear Information System (INIS)

    Blokhina, Svetlana; Sharapova, Angelica; Ol’khovich, Marina; Perlovich, German

    2017-01-01

    Highlights: • The vapor pressures of ciprofloxacin, enrofloxacin, norfloxacin and levofloxacin were measured. • The values of enthalpies, entropies and Gibbs energies of sublimation were calculated at T = 298.15 K. • Thermophysical characteristics of the studied compounds were determined. • The influence hydrogen bonds in crystal lattices on the sublimation enthalpy was discussed. - Abstract: The transpiration method was used to measure the vapor pressures as a function of temperature of the following antimicrobial drugs: ciprofloxacin, enrofloxacin, norfloxacin and levofloxacin. Based on these results standard molar enthalpies, entropies and Gibbs energies of sublimation at T = 298.15 K were calculated and a correlation between the crystal lattice energy and the saturation vapor pressure in a number of fluoroquinolones was found. The thermophysical characteristics of the compounds studied were determined by DSC. The influence of different structural fragments of molecules substituents and the effects of hydrogen bonds in crystal lattices on the sublimation enthalpy was discussed.

  9. Excess Gibbs Energy for Ternary Lattice Solutions of Nonrandom Mixing

    Energy Technology Data Exchange (ETDEWEB)

    Jung, Hae Young [DukSung Womens University, Seoul (Korea, Republic of)

    2008-12-15

    It is assumed for three components lattice solution that the number of ways of arranging particles randomly on the lattice follows a normal distribution of a linear combination of N{sub 12}, N{sub 23}, N{sub 13} which are the number of the nearest neighbor interactions between different molecules. It is shown by random number simulations that this assumption is reasonable. From this distribution, an approximate equation for the excess Gibbs energy of three components lattice solution is derived. Using this equation, several liquid-vapor equilibria are calculated and compared with the results from other equations.

  10. Inference with minimal Gibbs free energy in information field theory

    International Nuclear Information System (INIS)

    Ensslin, Torsten A.; Weig, Cornelius

    2010-01-01

    Non-linear and non-Gaussian signal inference problems are difficult to tackle. Renormalization techniques permit us to construct good estimators for the posterior signal mean within information field theory (IFT), but the approximations and assumptions made are not very obvious. Here we introduce the simple concept of minimal Gibbs free energy to IFT, and show that previous renormalization results emerge naturally. They can be understood as being the Gaussian approximation to the full posterior probability, which has maximal cross information with it. We derive optimized estimators for three applications, to illustrate the usage of the framework: (i) reconstruction of a log-normal signal from Poissonian data with background counts and point spread function, as it is needed for gamma ray astronomy and for cosmography using photometric galaxy redshifts, (ii) inference of a Gaussian signal with unknown spectrum, and (iii) inference of a Poissonian log-normal signal with unknown spectrum, the combination of (i) and (ii). Finally we explain how Gaussian knowledge states constructed by the minimal Gibbs free energy principle at different temperatures can be combined into a more accurate surrogate of the non-Gaussian posterior.

  11. Gibbs free energy of formation of UPb(s) compound

    International Nuclear Information System (INIS)

    Samui, Pradeep; Agarwal, Renu; Mishra, Ratikanta

    2012-01-01

    Liquid lead and lead-bismuth eutectic (LBE) are being explored as primary candidates for coolants in accelerator driven systems and in advanced nuclear reactors due to their favorable thermo-physical and chemical properties. They are also proposed to be used as spallation neutron source in ADS Reactor Systems. However, corrosion of structural materials (i.e. steel) presents a critical challenge for the use of liquid lead or LBE in advanced nuclear reactors. The interactions of liquid lead or LBE with clad and fuel is of great scientific and technological importance in the development of advanced nuclear reactors. Clad failure/breach can lead to reaction of coolant elements with fuel components. Thus the study of fuel-coolant interaction of U with Pb/Bi is important. The paper deals with the determination of Gibbs free energy of formation of U-rich phase i.e. UPb in Pb-U system, employing Knudsen effusion mass loss technique

  12. A Simple Method to Calculate the Temperature Dependence of the Gibbs Energy and Chemical Equilibrium Constants

    Science.gov (United States)

    Vargas, Francisco M.

    2014-01-01

    The temperature dependence of the Gibbs energy and important quantities such as Henry's law constants, activity coefficients, and chemical equilibrium constants is usually calculated by using the Gibbs-Helmholtz equation. Although, this is a well-known approach and traditionally covered as part of any physical chemistry course, the required…

  13. Chemical Disequilibria and Sources of Gibbs Free Energy Inside Enceladus

    Science.gov (United States)

    Zolotov, M. Y.

    2010-12-01

    Non-photosynthetic organisms use chemical disequilibria in the environment to gain metabolic energy from enzyme catalyzed oxidation-reduction (redox) reactions. The presence of carbon dioxide, ammonia, formaldehyde, methanol, methane and other hydrocarbons in the eruptive plume of Enceladus [1] implies diverse redox disequilibria in the interior. In the history of the moon, redox disequilibria could have been activated through melting of a volatile-rich ice and following water-rock-organic interactions. Previous and/or present aqueous processes are consistent with the detection of NaCl and Na2CO3/NaHCO3-bearing grains emitted from Enceladus [2]. A low K/Na ratio in the grains [2] and a low upper limit for N2 in the plume [3] indicate low temperature (possibly enzymes if organisms were (are) present. The redox conditions in aqueous systems and amounts of available Gibbs free energy should have been affected by the production, consumption and escape of hydrogen. Aqueous oxidation of minerals (Fe-Ni metal, Fe-Ni phosphides, etc.) accreted on Enceladus should have led to H2 production, which is consistent with H2 detection in the plume [1]. Numerical evaluations based on concentrations of plume gases [1] reveal sufficient energy sources available to support metabolically diverse life at a wide range of activities (a) of dissolved H2 (log aH2 from 0 to -10). Formaldehyde, carbon dioxide [c.f. 4], HCN (if it is present), methanol, acetylene and other hydrocarbons have the potential to react with H2 to form methane. Aqueous hydrogenations of acetylene, HCN and formaldehyde to produce methanol are energetically favorable as well. Both favorable hydrogenation and hydration of HCN lead to formation of ammonia. Condensed organic species could also participate in redox reactions. Methane and ammonia are the final products of these putative redox transformations. Sulfates may have not formed in cold and/or short-term aqueous environments with a limited H2 escape. In contrast to

  14. A comparison of various Gibbs energy dissipation correlations for predicting microbial growth yields

    Energy Technology Data Exchange (ETDEWEB)

    Liu, J.-S. [Laboratory of Chemical and Biochemical Engineering, Swiss Federal Institute of Technology, EPFL, CH-1015 Lausanne (Switzerland); Vojinovic, V. [Laboratory of Chemical and Biochemical Engineering, Swiss Federal Institute of Technology, EPFL, CH-1015 Lausanne (Switzerland); Patino, R. [Cinvestav-Merida, Departamento de Fisica Aplicada, Km. 6 carretera antigua a Progreso, AP 73 Cordemex, 97310 Merida, Yucatan (Mexico); Maskow, Th. [UFZ Centre for Environmental Research, Department of Environmental Microbiology, Permoserstrasse 15, D-04318 Leipzig (Germany); Stockar, U. von [Laboratory of Chemical and Biochemical Engineering, Swiss Federal Institute of Technology, EPFL, CH-1015 Lausanne (Switzerland)]. E-mail: urs.vonStockar@epfl.ch

    2007-06-25

    Thermodynamic analysis may be applied in order to predict microbial growth yields roughly, based on an empirical correlation of the Gibbs energy of the overall growth reaction or Gibbs energy dissipation. Due to the well-known trade-off between high biomass yield and high Gibbs energy dissipation necessary for fast growth, an optimal range of Gibbs energy dissipation exists and it can be correlated to physical characteristics of the growth substrates. A database previously available in the literature has been extended significantly in order to test such correlations. An analysis of the relationship between biomass yield and Gibbs energy dissipation reveals that one does not need a very precise estimation of the latter to predict the former roughly. Approximating the Gibbs energy dissipation with a constant universal value of -500 kJ C-mol{sup -1} of dry biomass grown predicts many experimental growth yields nearly as well as a carefully designed, complex correlation available from the literature, even though a number of predictions are grossly out of range. A new correlation for Gibbs energy dissipation is proposed which is just as accurate as the complex literature correlation despite its dramatically simpler structure.

  15. A comparison of various Gibbs energy dissipation correlations for predicting microbial growth yields

    International Nuclear Information System (INIS)

    Liu, J.-S.; Vojinovic, V.; Patino, R.; Maskow, Th.; Stockar, U. von

    2007-01-01

    Thermodynamic analysis may be applied in order to predict microbial growth yields roughly, based on an empirical correlation of the Gibbs energy of the overall growth reaction or Gibbs energy dissipation. Due to the well-known trade-off between high biomass yield and high Gibbs energy dissipation necessary for fast growth, an optimal range of Gibbs energy dissipation exists and it can be correlated to physical characteristics of the growth substrates. A database previously available in the literature has been extended significantly in order to test such correlations. An analysis of the relationship between biomass yield and Gibbs energy dissipation reveals that one does not need a very precise estimation of the latter to predict the former roughly. Approximating the Gibbs energy dissipation with a constant universal value of -500 kJ C-mol -1 of dry biomass grown predicts many experimental growth yields nearly as well as a carefully designed, complex correlation available from the literature, even though a number of predictions are grossly out of range. A new correlation for Gibbs energy dissipation is proposed which is just as accurate as the complex literature correlation despite its dramatically simpler structure

  16. Oxidation potentials, Gibbs energies, enthalpies and entropies of actinide ions in aqueous solutions

    International Nuclear Information System (INIS)

    1977-01-01

    The values of the Gibbs energy, enthalpy, and entropy of different actinide ions, thermodynamic characteristics of the processes of hydration of these ions, and the presently known ionization potentials of actinides are given. The enthalpy and entropy components of the oxidation potentials of actinide elements are considered. The curves of the dependence of the Gibbs energy of ion formation on the atomic number of the element and the Frost diagrams are analyzed. The diagram proposed by Frost represents the graphical dependence of the Gibbs energy of hydrated ions on the degree of oxidation of the element. Using the Frost diagram it is easy to establish whether a given ion is stable to disproportioning

  17. Determination of Gibbs energies of formation in aqueous solution using chemical engineering tools.

    Science.gov (United States)

    Toure, Oumar; Dussap, Claude-Gilles

    2016-08-01

    Standard Gibbs energies of formation are of primary importance in the field of biothermodynamics. In the absence of any directly measured values, thermodynamic calculations are required to determine the missing data. For several biochemical species, this study shows that the knowledge of the standard Gibbs energy of formation of the pure compounds (in the gaseous, solid or liquid states) enables to determine the corresponding standard Gibbs energies of formation in aqueous solutions. To do so, using chemical engineering tools (thermodynamic tables and a model enabling to predict activity coefficients, solvation Gibbs energies and pKa data), it becomes possible to determine the partial chemical potential of neutral and charged components in real metabolic conditions, even in concentrated mixtures. Copyright © 2016 Elsevier Ltd. All rights reserved.

  18. Proposed Empirical Entropy and Gibbs Energy Based on Observations of Scale Invariance in Open Nonequilibrium Systems.

    Science.gov (United States)

    Tuck, Adrian F

    2017-09-07

    There is no widely agreed definition of entropy, and consequently Gibbs energy, in open systems far from equilibrium. One recent approach has sought to formulate an entropy and Gibbs energy based on observed scale invariances in geophysical variables, particularly in atmospheric quantities, including the molecules constituting stratospheric chemistry. The Hamiltonian flux dynamics of energy in macroscopic open nonequilibrium systems maps to energy in equilibrium statistical thermodynamics, and corresponding equivalences of scale invariant variables with other relevant statistical mechanical variables such as entropy, Gibbs energy, and 1/(k Boltzmann T), are not just formally analogous but are also mappings. Three proof-of-concept representative examples from available adequate stratospheric chemistry observations-temperature, wind speed and ozone-are calculated, with the aim of applying these mappings and equivalences. Potential applications of the approach to scale invariant observations from the literature, involving scales from molecular through laboratory to astronomical, are considered. Theoretical support for the approach from the literature is discussed.

  19. Gibbs Energy Modeling of Digenite and Adjacent Solid-State Phases

    Science.gov (United States)

    Waldner, Peter

    2017-08-01

    All sulfur potential and phase diagram data available in the literature for solid-state equilibria related to digenite have been assessed. Thorough thermodynamic analysis at 1 bar total pressure has been performed. A three-sublattice approach has been developed to model the Gibbs energy of digenite as a function of composition and temperature using the compound energy formalism. The Gibbs energies of the adjacent solid-state phases covelitte and high-temperature chalcocite are also modeled treating both sulfides as stoichiometric compounds. The novel model for digenite offers new interpretation of experimental data, may contribute from a thermodynamic point of view to the elucidation of the role of copper species within the crystal structure and allows extrapolation to composition regimes richer in copper than stoichiometric digenite Cu2S. Preliminary predictions into the ternary Cu-Fe-S system at 1273 K (1000 °C) using the Gibbs energy model of digenite for calculating its iron solubility are promising.

  20. On Sublimation.

    Science.gov (United States)

    Civitarese, Giuseppe

    2016-10-01

    Although it encapsulates the Freudian theory of art, the theory of sublimation has become outmoded. What is more, since its inception there has always been something ill-defined about it. Does it use sexualized or de-sexualized drive energy? Is it a defence or an alternative to defence? Does it serve Eros or Thanatos? Is it useful in clinical work or is it unusable? The only, albeit uncertain, aid to a definition relies on the extrinsic criterion of concrete artistic realization. My aim here to revisit and possibly 'reinvent' sublimation in the light of certain principles of the pre-Romantic aesthetics of the sublime. Both are theories of spiritual elevation, in other words, elevation that moves towards abstract thinking, and of man's 'moral' achievement; and both attempt to explain the mystery of aesthetic experience. On the one hand, the aesthetics of the sublime offers a modern myth that helps us articulate a series of factors occasionally referred to by various authors as constitutive of sublimation but which have not been incorporated into a single organic framework: loss and early mourning work; the earlier existence of a catastrophic factor - to be regarded, depending on the situation, as either traumatic or simply 'negative'; the correspondence with a process of somatopsychic categorization which coincides with subjectivity. On the other hand, it also helps us grasp the experience of negative pleasure empathically, living it 'from the inside'. Copyright © 2016 Institute of Psychoanalysis.

  1. Gibbs free energy of formation of liquid lanthanide-bismuth alloys

    International Nuclear Information System (INIS)

    Sheng Jiawei; Yamana, Hajimu; Moriyama, Hirotake

    2001-01-01

    The linear free energy relationship developed by Sverjensky and Molling provides a way to predict Gibbs free energies of liquid Ln-Bi alloys formation from the known thermodynamic properties of aqueous trivalent lanthanides (Ln 3(5(6+ ). The Ln-Bi alloys are divided into two isostructural families named as the LnBi 2 (Ln=La, Ce, Pr, Nd and Pm) and LnBi (Ln=Sm, Eu, Gd, Tb, Dy, Ho, Er, Tm and Yb). The calculated Gibbs free energy values are well agreed with experimental data

  2. Vapor pressures and sublimation enthalpies of novel bicyclic heterocycle derivatives

    International Nuclear Information System (INIS)

    Blokhina, Svetlana V.; Ol’khovich, Marina V.; Sharapova, Angelica V.; Perlovich, German L.; Proshin, Alexey N.

    2014-01-01

    Highlights: • The vapor pressures of novel bicyclo-derivatives of amine were measured. • Thermodynamic functions of sublimation were calculated. • The influence of substituent structure and chemical nature on the vapor pressure was studied. -- Abstract: The vapor pressures of five novel bicyclic heterocycle derivatives were measured over the temperature 341.15 to 396.15 K using the transpiration method by means of an inert gas carrier. From these results the standard enthalpies and Gibbs free energies of sublimation at the temperature 298.15 K were calculated. The effects of alkyl- and chloro-substitutions on changes in the thermodynamic functions have been investigated. Quantitative structure–property relationship on the basis HYBOT physico-chemical descriptors for biologically active compounds have been developed to predict the sublimation enthalpies and Gibbs free energies of the compounds studied

  3. Determination of standard molar Gibbs energy of formation of Sm6UO12(s)

    International Nuclear Information System (INIS)

    Sahu, Manjulata; Dash, Smruti

    2015-01-01

    The standard molar Gibbs energies of formation of Sm 6 UO 12 (s) have been measured using an oxygen concentration cell with yttria stabilized zirconia as solid electrolyte. Δ f G o m (T) for Sm 6 UO 12 (s) has been calculated using the measured and required thermodynamic data from the literature. The calculated Gibbs energy expression in the temperature range 899 to 1127 K can be given as: Δ f G o m (Nd 6 UO 12 , s,T)/(±2.3) kJ∙ mol -1 = -6681 +1.099 (T/K) (899-1127 K)(T/K). (author)

  4. Experimental Determination of Third Derivative of the Gibbs Free Energy, G II

    DEFF Research Database (Denmark)

    Koga, Yoshikata; Westh, Peter; Inaba, Akira

    2010-01-01

    We have been evaluating third derivative quantities of the Gibbs free energy, G, by graphically differentiating the second derivatives that are accessible experimentally, and demonstrated their power in elucidating the mixing schemes in aqueous solutions. Here we determine directly one of the third...

  5. Specification and comparative calculation of enthalpies and Gibbs formation energies of anhydrous lanthanide nitrates

    International Nuclear Information System (INIS)

    Del' Pino, Kh.; Chukurov, P.M.; Drakin, S.I.

    1980-01-01

    Analyzed are the results of experimental depermination of formation enthalpies of waterless nitrates of lanthane cerium, praseodymium, neodymium and samarium. Using method of comparative calculation computed are enthalpies of formation of waterless lanthanide and yttrium nitrates. Calculated values of enthalpies and Gibbs energies of waterless lanthanide nitrate formation are tabulated

  6. Estimates of Gibbs free energies of formation of chlorinated aliphatic compounds

    NARCIS (Netherlands)

    Dolfing, Jan; Janssen, Dick B.

    1994-01-01

    The Gibbs free energy of formation of chlorinated aliphatic compounds was estimated with Mavrovouniotis' group contribution method. The group contribution of chlorine was estimated from the scarce data available on chlorinated aliphatics in the literature, and found to vary somewhat according to the

  7. The Gibbs Energy Basis and Construction of Boiling Point Diagrams in Binary Systems

    Science.gov (United States)

    Smith, Norman O.

    2004-01-01

    An illustration of how excess Gibbs energies of the components in binary systems can be used to construct boiling point diagrams is given. The underlying causes of the various types of behavior of the systems in terms of intermolecular forces and the method of calculating the coexisting liquid and vapor compositions in boiling point diagrams with…

  8. Prediction of Gibbs energies of formation and stability constants of some secondary uranium minerals containing the uranyl group

    International Nuclear Information System (INIS)

    Genderen, A.C.G. van; Weijden, C.H. van der

    1984-01-01

    For a group of minerals containing a common anion there exists a linear relationship between two parameters called ΔO and ΔF.ΔO is defined as the difference between the Gibbs energy of formation of a solid oxide and the Gibbs energy of formation of its aqueous cation, while ΔF is defined as the Gibbs energy of reaction of the formation of a mineral from the constituting oxide(s) and the acid. Using the Gibbs energies of formation of a number of known minerals the corresponding ΔO's and ΔF's were calculated and with the resulting regression equation it is possible to predict values for the Gibbs energies of formation of other minerals containing the same anion. This was done for 29 minerals containing the uranyl-ion together with phosphate, vanadate, arsenate or carbonate. (orig.)

  9. Gibbs free energy of formation of lanthanum rhodate by quadrupole mass spectrometer

    International Nuclear Information System (INIS)

    Prasad, R.; Banerjee, Aparna; Venugopal, V.

    2003-01-01

    The ternary oxide in the system La-Rh-O is of considerable importance because of its application in catalysis. Phase equilibria in the pseudo-binary system La 2 O 3 -Rh 2 O 3 has been investigated by Shevyakov et. al. Gibbs free energy of LaRhO 3 (s) was determined by Jacob et. al. using a solid state Galvanic cell in the temperature range 890 to 1310 K. No other thermodynamic data were available in the literature. Hence it was decided to determine Gibbs free energy of formation of LaRhO 3 (s) by an independent technique, viz. quadrupole mass spectrometer (QMS) coupled with a Knudsen effusion cell and the results are presented

  10. Molar Surface Gibbs Energy of the Aqueous Solution of Ionic Liquid [C4mim][Oac

    Institute of Scientific and Technical Information of China (English)

    TONG Jing; ZHENG Xu; TONG Jian; QU Ye; LIU Lu; LI Hui

    2017-01-01

    The values of density and surface tension for aqueous solution of ionic liquid(IL) 1-butyl-3-methylimidazolium acetate([C4mim][OAc]) with various molalities were measured in the range of 288.15-318.15 K at intervals of 5 K.On the basis of thermodynamics,a semi-empirical model-molar surface Gibbs energy model of the ionic liquid solution that could be used to predict the surface tension or molar volume of solutions was put forward.The predicted values of the surface tension for aqueous [C4im][OAc] and the corresponding experimental ones were highly correlated and extremely similar.In terms of the concept of the molar Gibbs energy,a new E(o)tv(o)s equation was obtained and each parameter of the new equation has a clear physical meaning.

  11. The thermodynamic properties of the upper continental crust: Exergy, Gibbs free energy and enthalpy

    International Nuclear Information System (INIS)

    Valero, Alicia; Valero, Antonio; Vieillard, Philippe

    2012-01-01

    This paper shows a comprehensive database of the thermodynamic properties of the most abundant minerals of the upper continental crust. For those substances whose thermodynamic properties are not listed in the literature, their enthalpy and Gibbs free energy are calculated with 11 different estimation methods described in this study, with associated errors of up to 10% with respect to values published in the literature. Thanks to this procedure we have been able to make a first estimation of the enthalpy, Gibbs free energy and exergy of the bulk upper continental crust and of each of the nearly 300 most abundant minerals contained in it. Finally, the chemical exergy of the continental crust is compared to the exergy of the concentrated mineral resources. The numbers obtained indicate the huge chemical exergy wealth of the crust: 6 × 10 6 Gtoe. However, this study shows that approximately only 0.01% of that amount can be effectively used by man.

  12. Direct measurements of the Gibbs free energy of OH using a CW tunable laser

    Science.gov (United States)

    Killinger, D. K.; Wang, C. C.

    1979-01-01

    The paper describes an absorption measurement for determining the Gibbs free energy of OH generated in a mixture of water and oxygen vapor. These measurements afford a direct verification of the accuracy of thermochemical data of H2O at high temperatures and pressures. The results indicate that values for the heat capacity of H2O obtained through numerical computations are correct within an experimental uncertainty of 0.15 cal/mole K.

  13. Standard Gibbs free energies for transfer of actinyl ions at the aqueous/organic solution interface

    International Nuclear Information System (INIS)

    Kitatsuji, Yoshihiro; Okugaki, Tomohiko; Kasuno, Megumi; Kubota, Hiroki; Maeda, Kohji; Kimura, Takaumi; Yoshida, Zenko; Kihara, Sorin

    2011-01-01

    Research highlights: → Standard Gibbs free energies for ion-transfer of tri- to hexavalent actinide ions. → Determination is based on distribution method combined with ion-transfer voltammetry. → Organic solvents examined are nitrobenzene, DCE, benzonitrile, acetophenone and NPOE. → Gibbs free energies of U(VI), Np(VI) and Pu(VI) are similar to each other. → Gibbs free energies of Np(V) is very large, comparing with ordinary monovalent cations. - Abstract: Standard Gibbs free energies for transfer (ΔG tr 0 ) of actinyl ions (AnO 2 z+ ; z = 2 or 1; An: U, Np, or Pu) between an aqueous solution and an organic solution were determined based on distribution method combined with voltammetry for ion transfer at the interface of two immiscible electrolyte solutions. The organic solutions examined were nitrobenzene, 1,2-dichloroethane, benzonitrile, acetophenone, and 2-nitrophenyl octyl ether. Irrespective of the type of organic solutions, ΔG tr 0 of UO 2 2+ ,NpO 2 2+ , and PuO 2 2+ were nearly equal to each other and slightly larger than that of Mg 2+ . The ΔG tr 0 of NpO 2 + was extraordinary large compared with those of ordinary monovalent cations. The dependence of ΔG tr 0 of AnO 2 z+ on the type of organic solutions was similar to that of H + or Mg 2+ . The ΔG tr 0 of An 3+ and An 4+ were also discussed briefly.

  14. Using Graphs of Gibbs Energy versus Temperature in General Chemistry Discussions of Phase Changes and Colligative Properties

    Science.gov (United States)

    Hanson, Robert M.; Riley, Patrick; Schwinefus, Jeff; Fischer, Paul J.

    2008-01-01

    The use of qualitative graphs of Gibbs energy versus temperature is described in the context of chemical demonstrations involving phase changes and colligative properties at the general chemistry level. (Contains 5 figures and 1 note.)

  15. Solid oxide galvanic cell for determination of Gibbs energy of formation of Tb6UO12(s)

    International Nuclear Information System (INIS)

    Sahu, Manjulata; Dash, Smruti

    2013-01-01

    Citrate-nitrate combustion method was used to synthesise Tb 6 UO 12 (s). Gibbs energy of formation of Tb 6 UO 12 (s) was measured using solid oxide galvanic cell in the temperature range 957-1175 K. (author)

  16. Size and shape dependent Gibbs free energy and phase stability of titanium and zirconium nanoparticles

    International Nuclear Information System (INIS)

    Xiong Shiyun; Qi Weihong; Huang Baiyun; Wang Mingpu; Li Yejun

    2010-01-01

    The Debye model of Helmholtz free energy for bulk material is generalized to Gibbs free energy (GFE) model for nanomaterial, while a shape factor is introduced to characterize the shape effect on GFE. The structural transitions of Ti and Zr nanoparticles are predicted based on GFE. It is further found that GFE decreases with the shape factor and increases with decreasing of the particle size. The critical size of structural transformation for nanoparticles goes up as temperature increases in the absence of change in shape factor. For specified temperature, the critical size climbs up with the increase of shape factor. The present predictions agree well with experiment values.

  17. Excess Gibbs energy for six binary solid solutions of molecularly simple substances

    Energy Technology Data Exchange (ETDEWEB)

    Lobo, L J; Staveley, L A.K.

    1985-01-01

    In this paper we apply the method developed in a previous study of Ar + CH/sub 4/ to the evaluation of the excess Gibbs energy G /SUP E.S/ for solid solutions of two molecularly simple components. The method depends on combining information on the excess Gibbs energy G /SUP E.L/ for the liquid mixture of the two components with a knowledge of the (T, x) solid-liquid phase diagram. Certain thermal properties o the pure substances are also needed. G /SUP E.S/ has been calculated for binary mixtures of Ar + Kr, Kr + CH/sub 4/, CO + N/sub 2/, Kr + Xe, Ar + N/sub 2/, and Ar + CO. In general, but not always, the solid mixtures are more non-ideal than the liquid mixtures of the same composition at the same temperature. Except for the Kr + CH/sub 4/ system, the ratio r = G /SUP E.S/ /G /SUP E.L/ is larger the richer the solution in the component with the smaller molecules.

  18. Gibbs Free Energy of Formation for Selected Platinum Group Minerals (PGM

    Directory of Open Access Journals (Sweden)

    Spiros Olivotos

    2016-01-01

    Full Text Available Thermodynamic data for platinum group (Os, Ir, Ru, Rh, Pd and Pt minerals are very limited. The present study is focused on the calculation of the Gibbs free energy of formation (ΔfG° for selected PGM occurring in layered intrusions and ophiolite complexes worldwide, applying available experimental data on their constituent elements at their standard state (ΔG = G(species − ΔG(elements, using the computer program HSC Chemistry software 6.0. The evaluation of the accuracy of the calculation method was made by the calculation of (ΔGf of rhodium sulfide phases. The calculated values were found to be ingood agreement with those measured in the binary system (Rh + S as a function of temperature by previous authors (Jacob and Gupta (2014. The calculated Gibbs free energy (ΔfG° followed the order RuS2 < (Ir,OsS2 < (Pt, PdS < (Pd, PtTe2, increasing from compatible to incompatible noble metals and from sulfides to tellurides.

  19. Extrapolation procedures for calculating high-temperature gibbs free energies of aqueous electrolytes

    International Nuclear Information System (INIS)

    Tremaine, P.R.

    1979-01-01

    Methods for calculating high-temprature Gibbs free energies of mononuclear cations and anions from room-temperature data are reviewed. Emphasis is given to species required for oxide solubility calculations relevant to mass transport situations in the nuclear industry. Free energies predicted by each method are compared to selected values calculated from recently reported solubility studies and other literature data. Values for monatomic ions estimated using the assumption anti C 0 p(T) = anti C 0 p(298) agree best with experiment to 423 K. From 423 K to 523 K, free energies from an electrostatic model for ion hydration are more accurate. Extrapolations for hydrolyzed species are limited by a lack of room-temperature entropy data and expressions for estimating these entropies are discussed. (orig.) [de

  20. Oxygen concentration cell for the measurements of the standard molar Gibbs energy of formation of Nd6UO12(s)

    International Nuclear Information System (INIS)

    Sahu, Manjulata; Dash, Smruti

    2011-01-01

    The standard molar Gibbs energies of formation of Nd 6 UO 12 (s) have been measured using an oxygen concentration cell with yttria stabilized zirconia as solid electrolyte. Δ f G m o (T) for Nd 6 UO 12 (s) has been calculated using the measured and required thermodynamic data from the literature. The calculated Gibbs energy expression can be given as: Δ f G m o (Nd 6 UO 12 , s,T)/(± 2.3) kJmol -1 = -6660.1+1.0898 (T/K). (author)

  1. Reduction efficiency prediction of CENIBRA's recovery boiler by direct minimization of gibbs free energy

    Directory of Open Access Journals (Sweden)

    W. L. Silva

    2008-09-01

    Full Text Available The reduction efficiency is an important variable during the black liquor burning process in the Kraft recovery boiler. This variable value is obtained by slow experimental routines and the delay of this measure disturbs the pulp and paper industry customary control. This paper describes an optimization approach for the reduction efficiency determination in the furnace bottom of the recovery boiler based on the minimization of the Gibbs free energy. The industrial data used in this study were directly obtained from CENIBRA's data acquisition system. The resulting approach is able to predict the steady state behavior of the chemical composition of the furnace recovery boiler, - especially the reduction efficiency when different operational conditions are used. This result confirms the potential of this approach in the analysis of the daily operation of the recovery boiler.

  2. Generalized Gibbs distribution and energy localization in the semiclassical FPU problem

    Science.gov (United States)

    Hipolito, Rafael; Danshita, Ippei; Oganesyan, Vadim; Polkovnikov, Anatoli

    2011-03-01

    We investigate dynamics of the weakly interacting quantum mechanical Fermi-Pasta-Ulam (qFPU) model in the semiclassical limit below the stochasticity threshold. Within this limit we find that initial quantum fluctuations lead to the damping of FPU oscillations and relaxation of the system to a slowly evolving steady state with energy localized within few momentum modes. We find that in large systems this state can be described by the generalized Gibbs ensemble (GGE), with the Lagrange multipliers being very weak functions of time. This ensembles gives accurate description of the instantaneous correlation functions, both quadratic and quartic. Based on these results we conjecture that GGE generically appears as a prethermalized state in weakly non-integrable systems.

  3. Standard molar Gibbs free energy of formation of URh3(s)

    International Nuclear Information System (INIS)

    Prasad, Rajendra; Sayi, Y.S.; Radhakrishna, J.; Yadav, C.S.; Shankaran, P.S.; Chhapru, G.C.

    1992-01-01

    Equilibrium partial pressures of CO(g) over the system (UO 2 (s) + C(s) + Rh(s) + URh 3 (s)) were measured in the temperature range 1327 - 1438 K. Standard Gibbs molar free energy of formation of URh 3 (Δ f G o m ) in the above temperature range can be expressed as Δ f G o m (URh 3 ,s,T)+-3.0(kJ/mol)= -348.165 + 0.03144 T(K). The second and third law enthalpy of formation, ΔfH o m (URh 3 ,s,298.15 K) are (-318.4 +- 3.0) and (298.3 +- 2.5) kJ/mol respectively. (author). 7 refs., 3 tabs

  4. The Gibbs free energy of homogeneous nucleation: From atomistic nuclei to the planar limit.

    Science.gov (United States)

    Cheng, Bingqing; Tribello, Gareth A; Ceriotti, Michele

    2017-09-14

    In this paper we discuss how the information contained in atomistic simulations of homogeneous nucleation should be used when fitting the parameters in macroscopic nucleation models. We show how the number of solid and liquid atoms in such simulations can be determined unambiguously by using a Gibbs dividing surface and how the free energy as a function of the number of solid atoms in the nucleus can thus be extracted. We then show that the parameters (the chemical potential, the interfacial free energy, and a Tolman correction) of a model based on classical nucleation theory can be fitted using the information contained in these free-energy profiles but that the parameters in such models are highly correlated. This correlation is unfortunate as it ensures that small errors in the computed free energy surface can give rise to large errors in the extrapolated properties of the fitted model. To resolve this problem we thus propose a method for fitting macroscopic nucleation models that uses simulations of planar interfaces and simulations of three-dimensional nuclei in tandem. We show that when the chemical potentials and the interface energy are pinned to their planar-interface values, more precise estimates for the Tolman length are obtained. Extrapolating the free energy profile obtained from small simulation boxes to larger nuclei is thus more reliable.

  5. A simple approach to the solvent reorganisation Gibbs free energy in electron transfer reactions of redox metalloproteins

    DEFF Research Database (Denmark)

    Ulstrup, Jens

    1999-01-01

    We discuss a simple model for the environmental reorganisation Gibbs free energy, E-r, in electron transfer between a metalloprotein and a small reaction partner. The protein is represented as a dielectric globule with low dielectric constant, the metal centres as conducting spheres, all embedded...

  6. The Concentration Dependence of the (Delta)s Term in the Gibbs Free Energy Function: Application to Reversible Reactions in Biochemistry

    Science.gov (United States)

    Gary, Ronald K.

    2004-01-01

    The concentration dependence of (delta)S term in the Gibbs free energy function is described in relation to its application to reversible reactions in biochemistry. An intuitive and non-mathematical argument for the concentration dependence of the (delta)S term in the Gibbs free energy equation is derived and the applicability of the equation to…

  7. Gibbs Free-Energy Gradient along the Path of Glucose Transport through Human Glucose Transporter 3.

    Science.gov (United States)

    Liang, Huiyun; Bourdon, Allen K; Chen, Liao Y; Phelix, Clyde F; Perry, George

    2018-06-11

    Fourteen glucose transporters (GLUTs) play essential roles in human physiology by facilitating glucose diffusion across the cell membrane. Due to its central role in the energy metabolism of the central nervous system, GLUT3 has been thoroughly investigated. However, the Gibbs free-energy gradient (what drives the facilitated diffusion of glucose) has not been mapped out along the transport path. Some fundamental questions remain. Here we present a molecular dynamics study of GLUT3 embedded in a lipid bilayer to quantify the free-energy profile along the entire transport path of attracting a β-d-glucose from the interstitium to the inside of GLUT3 and, from there, releasing it to the cytoplasm by Arrhenius thermal activation. From the free-energy profile, we elucidate the unique Michaelis-Menten characteristics of GLUT3, low K M and high V MAX , specifically suitable for neurons' high and constant demand of energy from their low-glucose environments. We compute GLUT3's binding free energy for β-d-glucose to be -4.6 kcal/mol in agreement with the experimental value of -4.4 kcal/mol ( K M = 1.4 mM). We also compute the hydration energy of β-d-glucose, -18.0 kcal/mol vs the experimental data, -17.8 kcal/mol. In this, we establish a dynamics-based connection from GLUT3's crystal structure to its cellular thermodynamics with quantitative accuracy. We predict equal Arrhenius barriers for glucose uptake and efflux through GLUT3 to be tested in future experiments.

  8. The Role of Shearing Energy and Interfacial Gibbs Free Energy in the Emulsification Mechanism of Waxy Crude Oil

    Directory of Open Access Journals (Sweden)

    Zhihua Wang

    2017-05-01

    Full Text Available Crude oil is generally produced with water, and the water cut produced by oil wells is increasingly common over their lifetime, so it is inevitable to create emulsions during oil production. However, the formation of emulsions presents a costly problem in surface process particularly, both in terms of transportation energy consumption and separation efficiency. To deal with the production and operational problems which are related to crude oil emulsions, especially to ensure the separation and transportation of crude oil-water systems, it is necessary to better understand the emulsification mechanism of crude oil under different conditions from the aspects of bulk and interfacial properties. The concept of shearing energy was introduced in this study to reveal the driving force for emulsification. The relationship between shearing stress in the flow field and interfacial tension (IFT was established, and the correlation between shearing energy and interfacial Gibbs free energy was developed. The potential of the developed correlation model was validated using the experimental and field data on emulsification behavior. It was also shown how droplet deformation could be predicted from a random deformation degree and orientation angle. The results indicated that shearing energy as the energy produced by shearing stress working in the flow field is the driving force activating the emulsification behavior. The deformation degree and orientation angle of dispersed phase droplet are associated with the interfacial properties, rheological properties and the experienced turbulence degree. The correlation between shearing stress and IFT can be quantified if droplet deformation degree vs. droplet orientation angle data is available. When the water cut is close to the inversion point of waxy crude oil emulsion, the interfacial Gibbs free energy change decreased and the shearing energy increased. This feature is also presented in the special regions where

  9. A procedure to compute equilibrium concentrations in multicomponent systems by Gibbs energy minimization on spreadsheets

    International Nuclear Information System (INIS)

    Lima da Silva, Aline; Heck, Nestor Cesar

    2003-01-01

    Equilibrium concentrations are traditionally calculated with the help of equilibrium constant equations from selected reactions. This procedure, however, is only useful for simpler problems. Analysis of the equilibrium state in a multicomponent and multiphase system necessarily involves solution of several simultaneous equations, and, as the number of system components grows, the required computation becomes more complex and tedious. A more direct and general method for solving the problem is the direct minimization of the Gibbs energy function. The solution for the nonlinear problem consists in minimizing the objective function (Gibbs energy of the system) subjected to the constraints of the elemental mass-balance. To solve it, usually a computer code is developed, which requires considerable testing and debugging efforts. In this work, a simple method to predict equilibrium composition in multicomponent systems is presented, which makes use of an electronic spreadsheet. The ability to carry out these calculations within a spreadsheet environment shows several advantages. First, spreadsheets are available 'universally' on nearly all personal computers. Second, the input and output capabilities of spreadsheets can be effectively used to monitor calculated results. Third, no additional systems or programs need to be learned. In this way, spreadsheets can be as suitable in computing equilibrium concentrations as well as to be used as teaching and learning aids. This work describes, therefore, the use of the Solver tool, contained in the Microsoft Excel spreadsheet package, on computing equilibrium concentrations in a multicomponent system, by the method of direct Gibbs energy minimization. The four phases Fe-Cr-O-C-Ni system is used as an example to illustrate the method proposed. The pure stoichiometric phases considered in equilibrium calculations are: Cr 2 O 3 (s) and FeO C r 2 O 3 (s). The atmosphere consists of O 2 , CO e CO 2 constituents. The liquid iron

  10. Comment on "Inference with minimal Gibbs free energy in information field theory".

    Science.gov (United States)

    Iatsenko, D; Stefanovska, A; McClintock, P V E

    2012-03-01

    Enßlin and Weig [Phys. Rev. E 82, 051112 (2010)] have introduced a "minimum Gibbs free energy" (MGFE) approach for estimation of the mean signal and signal uncertainty in Bayesian inference problems: it aims to combine the maximum a posteriori (MAP) and maximum entropy (ME) principles. We point out, however, that there are some important questions to be clarified before the new approach can be considered fully justified, and therefore able to be used with confidence. In particular, after obtaining a Gaussian approximation to the posterior in terms of the MGFE at some temperature T, this approximation should always be raised to the power of T to yield a reliable estimate. In addition, we show explicitly that MGFE indeed incorporates the MAP principle, as well as the MDI (minimum discrimination information) approach, but not the well-known ME principle of Jaynes [E.T. Jaynes, Phys. Rev. 106, 620 (1957)]. We also illuminate some related issues and resolve apparent discrepancies. Finally, we investigate the performance of MGFE estimation for different values of T, and we discuss the advantages and shortcomings of the approach.

  11. A Gibbs Energy Minimization Approach for Modeling of Chemical Reactions in a Basic Oxygen Furnace

    Science.gov (United States)

    Kruskopf, Ari; Visuri, Ville-Valtteri

    2017-12-01

    In modern steelmaking, the decarburization of hot metal is converted into steel primarily in converter processes, such as the basic oxygen furnace. The objective of this work was to develop a new mathematical model for top blown steel converter, which accounts for the complex reaction equilibria in the impact zone, also known as the hot spot, as well as the associated mass and heat transport. An in-house computer code of the model has been developed in Matlab. The main assumption of the model is that all reactions take place in a specified reaction zone. The mass transfer between the reaction volume, bulk slag, and metal determine the reaction rates for the species. The thermodynamic equilibrium is calculated using the partitioning of Gibbs energy (PGE) method. The activity model for the liquid metal is the unified interaction parameter model and for the liquid slag the modified quasichemical model (MQM). The MQM was validated by calculating iso-activity lines for the liquid slag components. The PGE method together with the MQM was validated by calculating liquidus lines for solid components. The results were compared with measurements from literature. The full chemical reaction model was validated by comparing the metal and slag compositions to measurements from industrial scale converter. The predictions were found to be in good agreement with the measured values. Furthermore, the accuracy of the model was found to compare favorably with the models proposed in the literature. The real-time capability of the proposed model was confirmed in test calculations.

  12. Gibbs energy of the resolvation of glycylglycine and its anion in aqueous solutions of dimethylsulfoxide at 298.15 K

    Science.gov (United States)

    Naumov, V. V.; Isaeva, V. A.; Kuzina, E. N.; Sharnin, V. A.

    2012-12-01

    Gibbs energies for the transfer of glycylglycine and glycylglycinate ions from water to water-dimethylsulfoxide solvents are determined from the interface distribution of substances between immiscible phases in the composition range of 0.00 to 0.20 molar fractions of DMSO at 298.15 K. It is shown that with a rise in the concentration of nonaqueous components in solution, we observe the solvation of dipeptide and its anion, due mainly to the destabilization of the carboxyl group.

  13. The thermodynamic approach to boron chemical vapour deposition based on a computer minimization of the total Gibbs free energy

    International Nuclear Information System (INIS)

    Naslain, R.; Thebault, J.; Hagenmuller, P.; Bernard, C.

    1979-01-01

    A thermodynamic approach based on the minimization of the total Gibbs free energy of the system is used to study the chemical vapour deposition (CVD) of boron from BCl 3 -H 2 or BBr 3 -H 2 mixtures on various types of substrates (at 1000 < T< 1900 K and 1 atm). In this approach it is assumed that states close to equilibrium are reached in the boron CVD apparatus. (Auth.)

  14. Phase relations and gibbs energies in the system Mn-Rh-O

    Science.gov (United States)

    Jacob, K. T.; Sriram, M. V.

    1994-07-01

    Phase relations in the system Mn-Rh-O are established at 1273 K by equilibrating different compositions either in evacuated quartz ampules or in pure oxygen at a pressure of 1.01 × 105 Pa. The quenched samples are examined by optical microscopy, X-ray diffraction, and energy-dispersive X-ray analysis (EDAX). The alloys and intermetallics in the binary Mn-Rh system are found to be in equilibrium with MnO. There is only one ternary compound, MnRh2O4, with normal spinel structure in the system. The compound Mn3O4 has a tetragonal structure at 1273 K. A solid solution is formed between MnRh2O4 and Mn3O4. The solid solution has the cubic structure over a large range of composition and coexists with metallic rhodium. The partial pressure of oxygen corresponding to this two-phase equilibrium is measured as a function of the composition of the spinel solid solution and temperature. A new solid-state cell, with three separate electrode compartments, is designed to measure accurately the chemical potential of oxygen in the two-phase mixture, Rh + Mn3-2xRh2xO4, which has 1 degree of freedom at constant temperature. From the electromotive force (emf), thermodynamic mixing properties of the Mn3O4-MnRh2O4 solid solution and Gibbs energy of formation of MnRh2O4 are deduced. The activities exhibit negative deviations from Raoult’s law for most of the composition range, except near Mn3O4, where a two-phase region exists. In the cubic phase, the entropy of mixing of the two Rh3+ and Mn3+ ions on the octahedral site of the spinel is ideal, and the enthalpy of mixing is positive and symmetric with respect to composition. For the formation of the spinel (sp) from component oxides with rock salt (rs) and orthorhombic (orth) structures according to the reaction, MnO (rs) + Rh2O3 (orth) → MnRh2O4 (sp), ΔG° = -49,680 + 1.56T (±500) J mol-1 The oxygen potentials corresponding to MnO + Mn3O4 and Rh + Rh2O3 equilibria are also obtained from potentiometric measurements on galvanic

  15. Gibbs Sampler-Based λ-Dynamics and Rao-Blackwell Estimator for Alchemical Free Energy Calculation.

    Science.gov (United States)

    Ding, Xinqiang; Vilseck, Jonah Z; Hayes, Ryan L; Brooks, Charles L

    2017-06-13

    λ-dynamics is a generalized ensemble method for alchemical free energy calculations. In traditional λ-dynamics, the alchemical switch variable λ is treated as a continuous variable ranging from 0 to 1 and an empirical estimator is utilized to approximate the free energy. In the present article, we describe an alternative formulation of λ-dynamics that utilizes the Gibbs sampler framework, which we call Gibbs sampler-based λ-dynamics (GSLD). GSLD, like traditional λ-dynamics, can be readily extended to calculate free energy differences between multiple ligands in one simulation. We also introduce a new free energy estimator, the Rao-Blackwell estimator (RBE), for use in conjunction with GSLD. Compared with the current empirical estimator, the advantage of RBE is that RBE is an unbiased estimator and its variance is usually smaller than the current empirical estimator. We also show that the multistate Bennett acceptance ratio equation or the unbinned weighted histogram analysis method equation can be derived using the RBE. We illustrate the use and performance of this new free energy computational framework by application to a simple harmonic system as well as relevant calculations of small molecule relative free energies of solvation and binding to a protein receptor. Our findings demonstrate consistent and improved performance compared with conventional alchemical free energy methods.

  16. Size Fluctuations of Near Critical Nuclei and Gibbs Free Energy for Nucleation of BDA on Cu(001)

    Science.gov (United States)

    Schwarz, Daniel; van Gastel, Raoul; Zandvliet, Harold J. W.; Poelsema, Bene

    2012-07-01

    We present a low-energy electron microscopy study of nucleation and growth of BDA on Cu(001) at low supersaturation. At sufficiently high coverage, a dilute BDA phase coexists with c(8×8) crystallites. The real-time microscopic information allows a direct visualization of near-critical nuclei, determination of the supersaturation and the line tension of the crystallites, and, thus, derivation of the Gibbs free energy for nucleation. The resulting critical nucleus size nicely agrees with the measured value. Nuclei up to 4-6 times larger still decay with finite probability, urging reconsideration of the classic perception of a critical nucleus.

  17. Gibbs free-energy difference between the glass and crystalline phases of a Ni-Zr alloy

    Science.gov (United States)

    Ohsaka, K.; Trinh, E. H.; Holzer, J. C.; Johnson, W. L.

    1993-01-01

    The heats of eutectic melting and devitrification, and the specific heats of the crystalline, glass, and liquid phases have been measured for a Ni24Zr76 alloy. The data are used to calculate the Gibbs free-energy difference, Delta G(AC), between the real glass and the crystal on an assumption that the liquid-glass transition is second order. The result shows that Delta G(AC) continuously increases as the temperature decreases in contrast to the ideal glass case where Delta G(AC) is assumed to be independent of temperature.

  18. Gibbs free energy difference between the undercooled liquid and the beta phase of a Ti-Cr alloy

    Science.gov (United States)

    Ohsaka, K.; Trinh, E. H.; Holzer, J. C.; Johnson, W. L.

    1992-01-01

    The heat of fusion and the specific heats of the solid and liquid have been experimentally determined for a Ti60Cr40 alloy. The data are used to evaluate the Gibbs free energy difference, delta-G, between the liquid and the beta phase as a function of temperature to verify a reported spontaneous vitrification (SV) of the beta phase in Ti-Cr alloys. The results show that SV of an undistorted beta phase in the Ti60Cr40 alloy at 873 K is not feasible because delta-G is positive at the temperature. However, delta-G may become negative with additional excess free energy to the beta phase in the form of defects.

  19. Coefficients of interphase distribution and Gibbs energy of the transfer of nicotinic acid from water into aqueous solutions of ethanol and dimethylsulfoxide

    Science.gov (United States)

    Grazhdan, K. V.; Gamov, G. A.; Dushina, S. V.; Sharnin, V. A.

    2012-11-01

    Coefficients of the interphase distribution of nicotinic acid are determined in aqueous solution systems of ethanol-hexane and DMSO-hexane at 25.0 ± 0.1°C. They are used to calculate the Gibbs energy of the transfer of nicotinic acid from water into aqueous solutions of ethanol and dimethylsulfoxide. The Gibbs energy values for the transfer of the molecular and zwitterionic forms of nicotinic acid are obtained by means of UV spectroscopy. The diametrically opposite effect of the composition of binary solvents on the transfer of the molecular and zwitterionic forms of nicotinic acid is noted.

  20. Standard Gibbs free energies of reactions of ozone with free radicals in aqueous solution: quantum-chemical calculations.

    Science.gov (United States)

    Naumov, Sergej; von Sonntag, Clemens

    2011-11-01

    Free radicals are common intermediates in the chemistry of ozone in aqueous solution. Their reactions with ozone have been probed by calculating the standard Gibbs free energies of such reactions using density functional theory (Jaguar 7.6 program). O(2) reacts fast and irreversibly only with simple carbon-centered radicals. In contrast, ozone also reacts irreversibly with conjugated carbon-centered radicals such as bisallylic (hydroxycylohexadienyl) radicals, with conjugated carbon/oxygen-centered radicals such as phenoxyl radicals, and even with nitrogen- oxygen-, sulfur-, and halogen-centered radicals. In these reactions, further ozone-reactive radicals are generated. Chain reactions may destroy ozone without giving rise to products other than O(2). This may be of importance when ozonation is used in pollution control, and reactions of free radicals with ozone have to be taken into account in modeling such processes.

  1. The standard Gibbs free energy of formation of lithium manganese oxides at the temperatures of (680, 740 and 800) K

    International Nuclear Information System (INIS)

    Rog, G.; Kucza, W.; Kozlowska-Rog, A.

    2004-01-01

    The standard Gibbs free energy of formation of LiMnO 2 and LiMn 2 O 4 at the temperatures of (680, 740 and 800) K has been determined with the help of the solid-state galvanic cells involving lithium-β-alumina electrolyte. The equilibrium electrical potentials of cathode containing Li x Mn 2 O 4 spinel, in the composition ranges 0≤x≤1 and 1≤x≤2, vs. metallic lithium in the reversible intercalation galvanic cell have been calculated. The existence of two-voltage plateaus which appeared during charging and discharging processes in reversible intercalation of lithium into Li x Mn 2 O 4 spinel, has been discussed

  2. Standard enthalpy, entropy and Gibbs free energy of formation of «A» type carbonate phosphocalcium hydroxyapatites

    International Nuclear Information System (INIS)

    Jebri, Sonia; Khattech, Ismail; Jemal, Mohamed

    2017-01-01

    Highlights: • A-type carbonate hydroxyapatites with 0 ⩽ x ⩽ 1 were prepared and characterized by DRX, IR spectroscopy and CHN analysis. • The heat of solution was measured in 9 wt% HNO 3 using an isoperibol calorimeter. • The standard enthalpy of formation was determined by thermochemical cycle. • Gibbs free energy has been deduced by estimating standard entropy of formation. • Carbonatation increases the stability till x = 0.6 mol. - Abstract: « A » type carbonate phosphocalcium hydroxyapatites having the general formula Ca 10 (PO 4 ) 6 (OH) (2-2x) (CO 3 ) x with 0 ⩽ x ⩽ 1, were prepared by solid gas reaction in the temperature range of 700–1000 °C. The obtained materials were characterized by X-ray diffraction and infrared spectroscopy. The carbonate content has been determined by C–H–N analysis. The heat of solution of these products was measured at T = 298 K in 9 wt% nitric acid solution using an isoperibol calorimeter. A thermochemical cycle was proposed and complementary experiences were performed in order to access to the standard enthalpies of formation of these phosphates. The results were compared to those previously obtained on apatites containing strontium and barium and show a decrease with the carbonate amount introduced in the lattice. This quantity becomes more negative as the ratio of substitution increases. Estimation of the entropy of formation allowed the determination of standard Gibbs free energy of formation of these compounds. The study showed that the substitution of hydroxyl by carbonate ions contributes to the stabilisation of the apatite structure.

  3. Use of linear free energy relationship to predict Gibbs free energies of formation of pyrochlore phases (CaMTi2O7)

    International Nuclear Information System (INIS)

    Xu, H.; Wang, Y.

    1999-01-01

    In this letter, a linear free energy relationship is used to predict the Gibbs free energies of formation of crystalline phases of pyrochlore and zirconolite families with stoichiometry of MCaTi 2 O 7 (or, CaMTi 2 O 7 ,) from the known thermodynamic properties of aqueous tetravalent cations (M 4+ ). The linear free energy relationship for tetravalent cations is expressed as ΔG f,M v X 0 =a M v X ΔG n,M 4+ 0 +b M v X +β M v X r M 4+ , where the coefficients a M v X , b M v X , and β M v X characterize a particular structural family of M v X, r M 4+ is the ionic radius of M 4+ cation, ΔG f,M v X 0 is the standard Gibbs free energy of formation of M v X, and ΔG n,M 4+ 0 is the standard non-solvation energy of cation M 4+ . The coefficients for the structural family of zirconolite with the stoichiometry of M 4+ CaTi 2 O 7 are estimated to be: a M v X =0.5717, b M v X =-4284.67 (kJ/mol), and β M v X =27.2 (kJ/mol nm). The coefficients for the structural family of pyrochlore with the stoichiometry of M 4+ CaTi 2 O 7 are estimated to be: a M v X =0.5717, b M v X =-4174.25 (kJ/mol), and β M v X =13.4 (kJ/mol nm). Using the linear free energy relationship, the Gibbs free energies of formation of various zirconolite and pyrochlore phases are calculated. (orig.)

  4. Thermodynamics of Micellar Systems : Comparison of Mass Action and Phase Equilibrium Models for the Calculation of Standard Gibbs Energies of Micelle Formation

    NARCIS (Netherlands)

    Blandamer, Michael J.; Cullis, Paul M.; Soldi, L. Giorgio; Engberts, Jan B.F.N.; Kacperska, Anna; Os, Nico M. van

    1995-01-01

    Micellar colloids are distinguished from other colloids by their association-dissociation equilibrium in solution between monomers, counter-ions and micelles. According to classical thermodynamics, the standard Gibbs energy of formation of micelles at fixed temperature and pressure can be related to

  5. Origin of the correlation between the standard Gibbs energies of ion transfer from water to a hydrophobic ionic liquid and to a molecular solvent

    Czech Academy of Sciences Publication Activity Database

    Langmaier, Jan; Záliš, Stanislav; Samec, Zdeněk; Bovtun, Viktor; Kempa, Martin

    2013-01-01

    Roč. 87, JAN 2013 (2013), s. 591-598 ISSN 0013-4686 R&D Projects: GA ČR GAP206/11/0707 Institutional support: RVO:61388955 ; RVO:68378271 Keywords : ionic liquid s * cyclic voltammetry * standard Gibbs energy of ion transfer Subject RIV: CG - Electrochemistry Impact factor: 4.086, year: 2013

  6. Thermodynamic analysis of ethanol/water system in a fuel cell reformer with the Gibbs energy minimization method

    International Nuclear Information System (INIS)

    Lima da Silva, Aline; De Fraga Malfatti, Celia; Heck, Nestor Cesar

    2003-01-01

    The use of fuel cells is a promising technology in the conversion of chemical to electrical energy. Due to environmental concerns related to the reduction of atmospheric pollution and greenhouse gases emissions such as CO 2 , NO x and hydrocarbons, there have been many researches about fuel cells using hydrogen as fuel. Hydrogen gas can be produced by several routes; a promising one is the steam reforming of ethanol. This route may become an important industrial process, especially for sugarcane producing countries. Ethanol is renewable energy and presents several advantages over other sources related to natural availability, storage and handling safety. In order to contribute to the understanding of the steam reforming of ethanol inside the reformer, this work displays a detailed thermodynamic analysis of the ethanol/water system, in the temperature range of 500-1200K, considering different H 2 O/ethanol reforming ratios. The equilibrium determinations were done with the help of the Gibbs energy minimization method using the Generalized Reduced Gradient algorithm (GRG). Based on literature data, the species considered in calculations were: H 2 , H 2 O, CO, CO 2 , CH 4 , C 2 H 4 , CH 3 CHO, C 2 H 5 OH (gas phase) and C gr . (graphite phase). The thermodynamic conditions for carbon deposition (probably soot) on catalyst during gas reforming were analyzed, in order to establish temperature ranges and H 2 O/ethanol ratios where carbon precipitation is not thermodynamically feasible. Experimental results from literature show that carbon deposition causes catalyst deactivation during reforming. This deactivation is due to encapsulating carbon that covers active phases on a catalyst substrate, e.g. Ni over Al 2 O 3 . In the present study, a mathematical relationship between Lagrange multipliers and the carbon activity (with reference to the graphite phase) was deduced, unveiling the carbon activity in the reformer atmosphere. From this, it is possible to foreseen if soot

  7. Development of Bi-phase sodium-oxygen-hydrogen chemical equilibrium calculation program (BISHOP) using Gibbs free energy minimization method

    International Nuclear Information System (INIS)

    Okano, Yasushi

    1999-08-01

    In order to analyze the reaction heat and compounds due to sodium combustion, the multiphase chemical equilibrium calculation program for chemical reaction among sodium, oxygen and hydrogen is developed in this study. The developed numerical program is named BISHOP; which denotes Bi-Phase, Sodium - Oxygen - Hydrogen, Chemical Equilibrium Calculation Program'. Gibbs free energy minimization method is used because of the special merits that easily add and change chemical species, and generally deal many thermochemical reaction systems in addition to constant temperature and pressure one. Three new methods are developed for solving multi-phase sodium reaction system in this study. One is to construct equation system by simplifying phase, and the other is to expand the Gibbs free energy minimization method into multi-phase system, and the last is to establish the effective searching method for the minimum value. Chemical compounds by the combustion of sodium in the air are calculated using BISHOP. The Calculated temperature and moisture conditions where sodium-oxide and hydroxide are formed qualitatively agree with the experiments. Deformation of sodium hydride is calculated by the program. The estimated result of the relationship between the deformation temperature and pressure closely agree with the well known experimental equation of Roy and Rodgers. It is concluded that BISHOP can be used for evaluated the combustion and deformation behaviors of sodium and its compounds. Hydrogen formation condition of the dump-tank room at the sodium leak event of FBR is quantitatively evaluated by BISHOP. It can be concluded that to keep the temperature of dump-tank room lower is effective method to suppress the formation of hydrogen. In case of choosing the lower inflammability limit of 4.1 mol% as the hydrogen concentration criterion, formation reaction of sodium hydride from sodium and hydrogen is facilitated below the room temperature of 800 K, and concentration of hydrogen

  8. Size fluctuations of near critical and Gibbs free energy for nucleation of BDA on Cu(001)

    NARCIS (Netherlands)

    Schwarz, Daniel; van Gastel, Raoul; Zandvliet, Henricus J.W.; Poelsema, Bene

    2012-01-01

    We present a low-energy electron microscopy study of nucleation and growth of BDA on Cu(001) at low supersaturation. At sufficiently high coverage, a dilute BDA phase coexists with c(8×8) crystallites. The real-time microscopic information allows a direct visualization of near-critical nuclei,

  9. Gibbs energy calculation of electrolytic plasma channel with inclusions of copper and copper oxide with Al-base

    Science.gov (United States)

    Posuvailo, V. M.; Klapkiv, M. D.; Student, M. M.; Sirak, Y. Y.; Pokhmurska, H. V.

    2017-03-01

    The oxide ceramic coating with copper inclusions was synthesized by the method of plasma electrolytic oxidation (PEO). Calculations of the Gibbs energies of reactions between the plasma channel elements with inclusions of copper and copper oxide were carried out. Two methods of forming the oxide-ceramic coatings on aluminum base in electrolytic plasma with copper inclusions were established. The first method - consist in the introduction of copper into the aluminum matrix, the second - copper oxide. During the synthesis of oxide ceramic coatings plasma channel does not react with copper and copper oxide-ceramic included in the coating. In the second case is reduction of copper oxide in interaction with elements of the plasma channel. The content of oxide-ceramic layer was investigated by X-ray and X-ray microelement analysis. The inclusions of copper, CuAl2, Cu9Al4 in the oxide-ceramic coatings were found. It was established that in the spark plasma channels alongside with the oxidation reaction occurs also the reaction aluminothermic reduction of the metal that allows us to dope the oxide-ceramic coating by metal the isobaric-isothermal potential oxidation of which is less negative than the potential of the aluminum oxide.

  10. THE PREDICTION OF pH BY GIBBS FREE ENERGY MINIMIZATION IN THE SUMP SOLUTION UNDER LOCA CONDITION OF PWR

    Directory of Open Access Journals (Sweden)

    HYOUNGJU YOON

    2013-02-01

    Full Text Available It is required that the pH of the sump solution should be above 7.0 to retain iodine in a liquid phase and be within the material compatibility constraints under LOCA condition of PWR. The pH of the sump solution can be determined by conventional chemical equilibrium constants or by the minimization of Gibbs free energy. The latter method developed as a computer code called SOLGASMIX-PV is more convenient than the former since various chemical components can be easily treated under LOCA conditions. In this study, SOLGASMIX-PV code was modified to accommodate the acidic and basic materials produced by radiolysis reactions and to calculate the pH of the sump solution. When the computed pH was compared with measured by the ORNL experiment to verify the reliability of the modified code, the error between two values was within 0.3 pH. Finally, two cases of calculation were performed for the SKN 3&4 and UCN 1&2. As results, pH of the sump solution for the SKN 3&4 was between 7.02 and 7.45, and for the UCN 1&2 plant between 8.07 and 9.41. Furthermore, it was found that the radiolysis reactions have insignificant effects on pH because the relative concentrations of HCl, HNO3, and Cs are very low.

  11. Gibbs free energy of reactions involving SiC, Si3N4, H2, and H2O as a function of temperature and pressure

    Science.gov (United States)

    Isham, M. A.

    1992-01-01

    Silicon carbide and silicon nitride are considered for application as structural materials and coating in advanced propulsion systems including nuclear thermal. Three-dimensional Gibbs free energy were constructed for reactions involving these materials in H2 and H2/H2O. Free energy plots are functions of temperature and pressure. Calculations used the definition of Gibbs free energy where the spontaneity of reactions is calculated as a function of temperature and pressure. Silicon carbide decomposes to Si and CH4 in pure H2 and forms a SiO2 scale in a wet atmosphere. Silicon nitride remains stable under all conditions. There was no apparent difference in reaction thermodynamics between ideal and Van der Waals treatment of gaseous species.

  12. Solubility and Standard Gibb's energies of transfer of alkali metal perchlorates, tetramethyl- and tetraethylammonium from water to aqua-acetone solvents

    International Nuclear Information System (INIS)

    Kireev, A.A.; Pak, T.G.; Bezuglyj, V.D.

    1996-01-01

    Solubilities of KClO 4 , RbClO 4 , CsClO 4 , (CH 3 ) 4 NClO 4 , (C 2 M 5 ) 4 NClO 4 in water and water-acetone mixtures are determined by the method of isothermal saturation at 298.15 K. Dissociation constants of alkali metal perchlorates are found by conductometric method. Solubility products and standard Gibbs energies of transfer of corresponding electrolytes from water into water-acetone solvents are calculated. The character of transfer Gibbs energy dependence on solvent composition is explained by preferred solvation of cations by acetone molecules and anions-by water molecules. Features of tetraalkyl ammonium ions are explained by large changes in energy of cavity formation for these ions

  13. Phase relations and Gibbs energies of spinel phases and solid solutions in the system Mg-Rh-O

    Energy Technology Data Exchange (ETDEWEB)

    Jacob, K.T., E-mail: katob@materials.iisc.ernet.in [Department of Materials Engineering, Indian Institute of Science, Bangalore 560 012 (India); Prusty, Debadutta [Department of Materials Engineering, Indian Institute of Science, Bangalore 560 012 (India); Kale, G.M. [Institute for Materials Research, University of Leeds, Leeds, LS2 9JT (United Kingdom)

    2012-02-05

    Highlights: Black-Right-Pointing-Pointer Refinement of phase diagram for the system Mg-Rh-O and thermodynamic data for spinel compounds MgRh{sub 2}O{sub 4} and Mg{sub 2}RhO{sub 4} is presented. Black-Right-Pointing-Pointer A solid-state electrochemical cell is used for thermodynamic measurement. Black-Right-Pointing-Pointer An advanced design of the solid-state electrochemical cell incorporating buffer electrodes is deployed to minimize polarization of working electrode. Black-Right-Pointing-Pointer Regular solution model for the spinel solid solution MgRh{sub 2}O{sub 4} - Mg{sub 2}RhO{sub 4} based on ideal mixing of cations on the octahedral site is proposed. Black-Right-Pointing-Pointer Factors responsible for stabilization of tetravalent rhodium in spinel compounds are identified. - Abstract: Pure stoichiometric MgRh{sub 2}O{sub 4} could not be prepared by solid state reaction from an equimolar mixture of MgO and Rh{sub 2}O{sub 3} in air. The spinel phase formed always contained excess of Mg and traces of Rh or Rh{sub 2}O{sub 3}. The spinel phase can be considered as a solid solution of Mg{sub 2}RhO{sub 4} in MgRh{sub 2}O{sub 4}. The compositions of the spinel solid solution in equilibrium with different phases in the ternary system Mg-Rh-O were determined by electron probe microanalysis. The oxygen potential established by the equilibrium between Rh + MgO + Mg{sub 1+x}Rh{sub 2-x}O{sub 4} was measured as a function of temperature using a solid-state cell incorporating yttria-stabilized zirconia as an electrolyte and pure oxygen at 0.1 MPa as the reference electrode. To avoid polarization of the working electrode during the measurements, an improved design of the cell with a buffer electrode was used. The standard Gibbs energies of formation of MgRh{sub 2}O{sub 4} and Mg{sub 2}RhO{sub 4} were deduced from the measured electromotive force (e.m.f.) by invoking a model for the spinel solid solution. The parameters of the model were optimized using the measured

  14. Gibbs free energy of transfer of a methylene group on {UCON + (sodium or potassium) phosphate salts} aqueous two-phase systems: Hydrophobicity effects

    International Nuclear Information System (INIS)

    Silverio, Sara C.; Rodriguez, Oscar; Teixeira, Jose A.; Macedo, Eugenia A.

    2010-01-01

    The Gibbs free energy of transfer of a suitable hydrophobic probe can be regarded as a measure of the relative hydrophobicity of the different phases. The methylene group (CH 2 ) can be considered hydrophobic, and thus be a suitable probe for hydrophobicity. In this work, the partition coefficients of a series of five dinitrophenylated-amino acids were experimentally determined, at 23 o C, in three different tie-lines of the biphasic systems: (UCON + K 2 HPO 4 ), (UCON + potassium phosphate buffer, pH 7), (UCON + KH 2 PO 4 ), (UCON + Na 2 HPO 4 ), (UCON + sodium phosphate buffer, pH 7), and (UCON + NaH 2 PO 4 ). The Gibbs free energy of transfer of CH 2 units were calculated from the partition coefficients and used to compare the relative hydrophobicity of the equilibrium phases. The largest relative hydrophobicity was found for the ATPS formed by dihydrogen phosphate salts.

  15. Gibbs energies of formation of zircon (ZrSiO4), thorite (ThSiO4), and phenacite (Be2SiO4)

    International Nuclear Information System (INIS)

    Schuiling, R.D.; Vergouwen, L.; Rijst, H. van der

    1976-01-01

    Zircon, thorite, and phenacite are very refractory compounds which do not yield to solution calorimetry. In In order to obtain approximate Gibbs energies of formation for these minerals, their reactions with a number of silica-undersaturated compounds (silicates or oxides) were studied. Conversely baddeleyite (ZrO 2 ), thorianite (ThO 2 ), and bromellite (BeO) were reacted with the appropriate silicates. As the Gibbs energies of reaction of the undersaturated compounds with SiO 2 are known, the experiments yield the following data: Δ G 298 , 1 /sub bar/ 0 = -459.02 +- 1.04 kcal for zircon, -489.67 +- 1.04 for thorite, and -480.20 +- 1.01 for phenacite

  16. Using self-consistent Gibbs free energy surfaces to calculate size distributions of neutral and charged clusters for the sulfuric acid-water binary system

    Science.gov (United States)

    Smith, J. A.; Froyd, K. D.; Toon, O. B.

    2012-12-01

    We construct tables of reaction enthalpies and entropies for the association reactions involving sulfuric acid vapor, water vapor, and the bisulfate ion. These tables are created from experimental measurements and quantum chemical calculations for molecular clusters and a classical thermodynamic model for larger clusters. These initial tables are not thermodynamically consistent. For example, the Gibbs free energy of associating a cluster consisting of one acid molecule and two water molecules depends on the order in which the cluster was assembled: add two waters and then the acid or add an acid and a water and then the second water. We adjust the values within the tables using the method of Lagrange multipliers to minimize the adjustments and produce self-consistent Gibbs free energy surfaces for the neutral clusters and the charged clusters. With the self-consistent Gibbs free energy surfaces, we calculate size distributions of neutral and charged clusters for a variety of atmospheric conditions. Depending on the conditions, nucleation can be dominated by growth along the neutral channel or growth along the ion channel followed by ion-ion recombination.

  17. Standard Gibbs energies of formation and equilibrium constants from ab-initio calculations: Covalent dimerization of NO2 and synthesis of NH3

    International Nuclear Information System (INIS)

    Awasthi, Neha; Ritschel, Thomas; Lipowsky, Reinhard; Knecht, Volker

    2013-01-01

    Highlights: • ΔG and K eq for NO 2 dimerization and NH 3 synthesis calculated via ab-initio methods. • Vis-á-vis experiments, W1 and CCSD(T) are accurate and G3B3 also does quite well. • CBS-APNO most accurate for NH 3 reaction but shows limitations in modeling NO 2 . • Temperature dependence of ΔG and K eq is calculated for the NH 3 reaction. • Good agreement of calculated K eq with experiments and the van’t Hoff approximation. -- Abstract: Standard quantum chemical methods are used for accurate calculation of thermochemical properties such as enthalpies of formation, entropies and Gibbs energies of formation. Equilibrium reactions are widely investigated and experimental measurements often lead to a range of reaction Gibbs energies and equilibrium constants. It is useful to calculate these equilibrium properties from quantum chemical methods in order to address the experimental differences. Furthermore, most standard calculation methods differ in accuracy and feasibility of the system size. Hence, a systematic comparison of equilibrium properties calculated with different numerical algorithms would provide a useful reference. We select two well-known gas phase equilibrium reactions with small molecules: covalent dimer formation of NO 2 (2NO 2 ⇌ N 2 O 4 ) and the synthesis of NH 3 (N 2 + 3 H 2 ⇌ 2NH 3 ). We test four quantum chemical methods denoted by G3B3, CBS-APNO, W1 and CCSD(T) with aug-cc-pVXZ basis sets (X = 2, 3, and 4), to obtain thermochemical data for NO 2 , N 2 O 4 , and NH 3 . The calculated standard formation Gibbs energies Δ f G° are used to calculate standard reaction Gibbs energies Δ r G° and standard equilibrium constants K eq for the two reactions. Standard formation enthalpies Δ f H° are calculated in a more reliable way using high-level methods such as W1 and CCSD(T). Standard entropies S° for the molecules are calculated well within the range of experiments for all methods, however, the values of standard formation

  18. Josiah Willard Gibbs

    Indian Academy of Sciences (India)

    The younger Gibbs grew up in the liberal and academic atmos- phere at Yale, where .... research in the premier European universities at the time when a similar culture ... tion in obscure journals, Gibbs' work did not receive wide recognition in ...

  19. Gibbs Free Energy of Hydrolytic Water Molecule in Acyl-Enzyme Intermediates of a Serine Protease: A Potential Application for Computer-Aided Discovery of Mechanism-Based Reversible Covalent Inhibitors.

    Science.gov (United States)

    Masuda, Yosuke; Yamaotsu, Noriyuki; Hirono, Shuichi

    2017-01-01

    In order to predict the potencies of mechanism-based reversible covalent inhibitors, the relationships between calculated Gibbs free energy of hydrolytic water molecule in acyl-trypsin intermediates and experimentally measured catalytic rate constants (k cat ) were investigated. After obtaining representative solution structures by molecular dynamics (MD) simulations, hydration thermodynamics analyses using WaterMap™ were conducted. Consequently, we found for the first time that when Gibbs free energy of the hydrolytic water molecule was lower, logarithms of k cat were also lower. The hydrolytic water molecule with favorable Gibbs free energy may hydrolyze acylated serine slowly. Gibbs free energy of hydrolytic water molecule might be a useful descriptor for computer-aided discovery of mechanism-based reversible covalent inhibitors of hydrolytic enzymes.

  20. Instant Sublime Text starter

    CERN Document Server

    Haughee, Eric

    2013-01-01

    A starter which teaches the basic tasks to be performed with Sublime Text with the necessary practical examples and screenshots. This book requires only basic knowledge of the Internet and basic familiarity with any one of the three major operating systems, Windows, Linux, or Mac OS X. However, as Sublime Text 2 is primarily a text editor for writing software, many of the topics discussed will be specifically relevant to software development. That being said, the Sublime Text 2 Starter is also suitable for someone without a programming background who may be looking to learn one of the tools of

  1. Activity coefficients and excess Gibbs' free energy of some binary mixtures formed by p-cresol at 95.23 kPa

    Energy Technology Data Exchange (ETDEWEB)

    Prasad, T.E. Vittal [Properties Group, Chemical Engineering Laboratory, Indian Institute of Chemical Technology, Hyderabad 500 007 (India); Venkanna, N. [Swamy Ramanandateertha Institute of Science and Technology, Hyderabad 508 004 (India); Kumar, Y. Naveen [Swamy Ramanandateertha Institute of Science and Technology, Hyderabad 508 004 (India); Ashok, K. [Swamy Ramanandateertha Institute of Science and Technology, Hyderabad 508 004 (India); Sirisha, N.M. [Swamy Ramanandateertha Institute of Science and Technology, Hyderabad 508 004 (India); Prasad, D.H.L. [Properties Group, Chemical Engineering Laboratory, Indian Institute of Chemical Technology, Hyderabad 500 007 (India)]. E-mail: dasika@iict.res.in

    2007-07-15

    Bubble point temperatures at 95.23 kPa, over the entire composition range are measured for the binary mixtures formed by p-cresol with 1,2-dichloroethane, 1,1,2,2-tetrachloroethane trichloroethylene, tetrachloroethylene, and o- , m- , and p-xylenes, making use of a Swietoslawski-type ebulliometer. Liquid phase mole fraction (x {sub 1}) versus bubble point temperature (T) measurements are found to be well represented by the Wilson model. The optimum Wilson parameters are used to calculate the vapor phase composition, activity coefficients, and excess Gibbs free energy. The results are discussed.

  2. Thermodynamic description of the Al–Mg–Si system using a new formulation for the temperature dependence of the excess Gibbs energy

    International Nuclear Information System (INIS)

    Tang, Ying; Du, Yong; Zhang, Lijun; Yuan, Xiaoming; Kaptay, George

    2012-01-01

    Highlights: ► An exponential formulation to describe ternary excess Gibbs energy is proposed. ► Theoretical analysis is performed to verify stability of phase using new formulation. ► Al–Mg–Si system and its boundary binaries have been assessed by the new formulation. ► Present calculations for Al–Mg–Si system are more reasonable than previous ones. - Abstract: An exponential formulation was proposed to replace the linear interaction parameter in the Redlich–Kister (R–K) polynomial for the excess Gibbs energy of ternary solution phase. The theoretical analysis indicates that the proposed new exponential formulation can not only avoid the artificial miscibility gap at high temperatures but also describe the ternary system well. A thermodynamic description for the Al–Mg–Si system and its boundary binaries was then performed by using both R–K linear and exponential formulations. The inverted miscibility gaps occurring in the Mg–Si and the Al–Mg–Si systems at high temperatures due to the use of R–K linear polynomials are avoided by using the new formulation. Besides, the thermodynamic properties predicted with the new formulation confirm the general thermodynamic belief that the solution phase approaches to the ideal solution at infinite temperatures, which cannot be described with the traditional R–K linear polynomials.

  3. Gibb's energy and intermolecular free length of 'Borassus Flabellifier' (BF) and Adansonia digitata (AnD) aqueous binary mixture

    International Nuclear Information System (INIS)

    Phadke, Sushil; Shrivastava, Bhakt Darshan; Ujle, S K; Mishra, Ashutosh; Dagaonkar, N

    2014-01-01

    One of the potential driving forces behind a chemical reaction is favourable a new quantity known as the Gibbs free energy (G) of the system, which reflects the balance between these forces. Ultrasonic velocity and absorption measurements in liquids and liquid mixtures find extensive application to study the nature of intermolecular forces. Ultrasonic velocity measurements have been successfully employed to detect weak and strong molecular interactions present in binary and ternary liquid mixtures. After measuring the density and ultrasonic velocity of aqueous solution of 'Borassus Flabellifier' BF and Adansonia digitata And, we calculated Gibb's energy and intermolecular free length. The velocity of ultrasonic waves was measured, using a multi-frequency ultrasonic interferometer with a high degree of accuracy operating Model M-84 by M/s Mittal Enterprises, New Delhi, at a fixed frequency of 2 MHz. Natural sample 'Borassus Flabellifier' BF fruit pulp and Adansonia digitata AnD powder was collected from Dhar, District of MP, India for this study.

  4. Comparative study of solute trapping and Gibbs free energy changes at the phase interface during alloy solidification under local nonequilibrium conditions

    Energy Technology Data Exchange (ETDEWEB)

    Sobolev, S. L., E-mail: sobolev@icp.ac.ru [Russian Academy of Sciences, Institute of Problems of Chemical Physics (Russian Federation)

    2017-03-15

    An analytical model has been developed to describe the influence of solute trapping during rapid alloy solidification on the components of the Gibbs free energy change at the phase interface with emphasis on the solute drag energy. For relatively low interface velocity V < V{sub D}, where V{sub D} is the characteristic diffusion velocity, all the components, namely mixing part, local nonequilibrium part, and solute drag, significantly depend on solute diffusion and partitioning. When V ≥ V{sub D}, the local nonequilibrium effects lead to a sharp transition to diffusionless solidification. The transition is accompanied by complete solute trapping and vanishing solute drag energy, i.e. partitionless and “dragless” solidification.

  5. Strand Analysis, a free online program for the computational identification of the best RNA interference (RNAi targets based on Gibbs free energy

    Directory of Open Access Journals (Sweden)

    Tiago Campos Pereira

    2007-01-01

    Full Text Available The RNA interference (RNAi technique is a recent technology that uses double-stranded RNA molecules to promote potent and specific gene silencing. The application of this technique to molecular biology has increased considerably, from gene function identification to disease treatment. However, not all small interfering RNAs (siRNAs are equally efficient, making target selection an essential procedure. Here we present Strand Analysis (SA, a free online software tool able to identify and classify the best RNAi targets based on Gibbs free energy (deltaG. Furthermore, particular features of the software, such as the free energy landscape and deltaG gradient, may be used to shed light on RNA-induced silencing complex (RISC activity and RNAi mechanisms, which makes the SA software a distinct and innovative tool.

  6. Gibbs-non-Gibbs transitions and vector-valued integration

    NARCIS (Netherlands)

    Zuijlen, van W.B.

    2016-01-01

    This thesis consists of two distinct topics. The first part of the thesis con- siders Gibbs-non-Gibbs transitions. Gibbs measures describe the macro- scopic state of a system of a large number of components that is in equilib- rium. It may happen that when the system is transformed, for example, by

  7. Vapour pressure and excess Gibbs free energy of binary mixtures of hydrogen sulphide with ethane, propane, and n-butane at temperature of 182.33K

    International Nuclear Information System (INIS)

    Lobo, L.Q.; Ferreira, A.G.M.; Fonseca, I.M.A.; Senra, A.M.P.

    2006-01-01

    The vapour pressure of binary mixtures of hydrogen sulphide with ethane, propane, and n-butane was measured at T=182.33K covering most of the composition range. The excess Gibbs free energy of these mixtures has been derived from the measurements made. For the equimolar mixtures G m E (x 1 =0.5)=(835.5+/-5.8)J.mol -1 for (H 2 S+C 2 H 6 ) (820.1+/-2.4)J.mol -1 for (H 2 S+C 3 H 8 ), and (818.6+/-0.9)J.mol -1 for (H 2 S+n-C 4 H 10 ). The binary mixtures of H 2 S with ethane and with propane exhibit azeotropes, but that with n-butane does not

  8. The Ideal Ionic Liquid Salt Bridge for the Direct Determination of Gibbs Energies of Transfer of Single Ions, Part I: The Concept.

    Science.gov (United States)

    Radtke, Valentin; Ermantraut, Andreas; Himmel, Daniel; Koslowski, Thorsten; Leito, Ivo; Krossing, Ingo

    2018-02-23

    Described is a procedure for the thermodynamically rigorous, experimental determination of the Gibbs energy of transfer of single ions between solvents. The method is based on potential difference measurements between two electrochemical half cells with different solvents connected by an ideal ionic liquid salt bridge (ILSB). Discussed are the specific requirements for the IL with regard to the procedure, thus ensuring that the liquid junction potentials (LJP) at both ends of the ILSB are mostly canceled. The remaining parts of the LJPs can be determined by separate electromotive force measurements. No extra-thermodynamic assumptions are necessary for this procedure. The accuracy of the measurements depends, amongst others, on the ideality of the IL used, as shown in our companion paper Part II. © 2018 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

  9. Gibbs energy modelling of the driving forces and calculation of the fcc/hcp martensitic transformation temperatures in Fe-Mn and Fe-Mn-Si alloys

    International Nuclear Information System (INIS)

    Cotes, S.; Fernandez Guillermet, A.; Sade, M.

    1999-01-01

    Very recent, accurate dilatometric measurements of the fcc hcp martensitic transformation (MT) temperatures are used to develop a new thermodynamic description of the fcc and hcp phases in the Fe-Mn-Si system, based on phenomenological models for the Gibbs energy function. The composition dependence of the driving forces for the fcc→hcp and the hcp→fcc MTs is established. Detailed calculations of the MT temperatures are reported, which are used to investigate the systematic effects of Si additions upon the MT temperatures of Fe-Mn alloys. A critical comparison with one of the most recent thermodynamic analyses of the Fe-Mn-Si system, which is due to Forsberg and Agren, is also presented. (orig.)

  10. Kinetics of dihydro-dibenz[b,f]azepine derivatives sublimation

    International Nuclear Information System (INIS)

    Krongauz, V.V.; Ling, M.T.K.; Woo, L.; Purohit, U.

    2007-01-01

    Sublimation of dihydro-dibenz[b,f]azepine derivatives upon heating was studied and confirmed by thermogravimetry (TGA) and differential scanning calorimetry (DSC). DSC was used to analyze thermodynamics of melting. The kinetics of dihydro-dibenz[b,f]azepine derivatives sublimation were monitored by TGA as a function of temperature. Activation energies of sublimation were deduced and correlated with melting enthalpies and molecular structure. The results indicated that the sublimation was controlled by intermolecular forces in the crystalline lattice of dihydro-dibenz[b,f]azepine derivatives

  11. Towards an understanding of the molecular mechanism of solvation of drug molecules: a thermodynamic approach by crystal lattice energy, sublimation, and solubility exemplified by paracetamol, acetanilide, and phenacetin.

    Science.gov (United States)

    Perlovich, German L; Volkova, Tatyana V; Bauer-Brandl, Annette

    2006-10-01

    Temperature dependencies of saturated vapor pressure for the monoclinic modification of paracetamol (acetaminophen), acetanilide, and phenacetin (acetophenetidin) were measured and thermodynamic functions of sublimation calculated (paracetamol: DeltaGsub298=60.0 kJ/mol; DeltaHsub298=117.9+/-0.7 kJ/mol; DeltaSsub298=190+/-2 J/mol.K; acetanilide: DeltaGsub298=40.5 kJ/mol; DeltaHsub298=99.8+/-0.8 kJ/mol; DeltaSsub298=197+/-2 J/mol.K; phenacetin: DeltaGsub298=52.3 kJ/mol; DeltaHsub298=121.8+/-0.7 kJ/mol; DeltaSsub298=226+/-2 J/mol.K). Analysis of packing energies based on geometry optimization of molecules in the crystal lattices using diffraction data and the program Dmol3 was carried out. Parameters analyzed were: (a) energetic contribution of van der Waals forces and hydrogen bonding to the total packing energy; (b) contributions of fragments of the molecules to the packing energy. The fraction of hydrogen bond energy in the packing energy increases as: phenacetin (17.5%)acetanilide (20.4%)acetanilide and phenacetin, entropy driven. Copyright (c) 2006 Wiley-Liss, Inc. and the American Pharmacists Association

  12. Sublimation, culture, and creativity.

    Science.gov (United States)

    Kim, Emily; Zeppenfeld, Veronika; Cohen, Dov

    2013-10-01

    Combining insights from Freud and Weber, this article explores whether Protestants (vs. Catholics and Jews) are more likely to sublimate their taboo feelings and desires toward productive ends. In the Terman sample (Study 1), Protestant men and women who had sexual problems related to anxieties about taboos and depravity had greater creative accomplishments, as compared to those with sexual problems unrelated to such concerns and to those reporting no sexual problems. Two laboratory experiments (Studies 2 and 3) found that Protestants produced more creative artwork (sculptures, poems, collages, cartoon captions) when they were (a) primed with damnation-related words, (b) induced to feel unacceptable sexual desires, or (c) forced to suppress their anger. Activating anger or sexual attraction was not enough; it was the forbidden or suppressed nature of the emotion that gave the emotion its creative power. The studies provide possibly the first experimental evidence for sublimation and suggest a cultural psychological approach to defense mechanisms.

  13. Calculation of Gibbs energy of Zr-Al-Ni, Zr-Al-Cu, Al-Ni-Cu and Zr-Al-Ni-Cu liquid alloys based on quasiregular solution model

    International Nuclear Information System (INIS)

    Li, H.Q.; Yang, Y.S.; Tong, W.H.; Wang, Z.Y.

    2007-01-01

    With the effects of electronic structure and atomic size being introduced, the mixing enthalpy as well as the Gibbs energy of the ternary Zr-Al-Cu, Ni-Al-Cu, Zr-Ni-Al and quaternary Zr-Al-Ni-Cu systems are calculated based on quasiregular solution model. The computed results agree well with the experimental data. The sequence of Gibbs energies of different systems is: G Zr-Al-Ni-Cu Zr-Al-Ni Zr-Al-Cu Cu-Al-Ni . To Zr-Al-Cu, Ni-Al-Cu and Zr-Ni-Al, the lowest Gibbs energy locates in the composition range of X Zr 0.39-0.61, X Al = 0.38-0.61; X Ni = 0.39-0.61, X Al = 0.38-0.60 and X Zr = 0.32-0.67, X Al = 0.32-0.66, respectively. And to the Zr-Ni-Al-Cu system with 66.67% Zr, the lowest Gibbs energy is obtained in the region of X Al = 0.63-0.80, X Ni = 0.14-0.24

  14. Use of linear free energy relationship to predict Gibbs free energies of formation of zirconolite phases (MZrTi2O7 and MHfTi2O7)

    International Nuclear Information System (INIS)

    Xu, H.

    1999-01-01

    In this letter, the Sverjensky-Molling equation derived from a linear free energy relationship is used to calculate the Gibbs free energies of formation of zirconolite crystalline phases (MZrTi 2 O 7 and MHfTi 2 O 7 ) from the known thermodynamic properties of the corresponding aqueous divalent cations (M 2+ ). Sverjensky-Molling equation is expressed as ΔG 0 f,M v X =a M v X ΔG 0 n,M 2+ +b M v X +β M v X r M 2+ , where the coefficients a M v X , b M v X , and β M v X characterize a particular structural family of M v X, r M 2+ is the ionic radius of M 2+ cation, ΔG f,M v X 0 is the standard Gibbs free energy of formation of M v X, and ΔG 0 n,M 2+ is the standard non-solvation energy of cation M 2+ . This relationship can be used to predict the Gibbs free energies of formation of various fictive phases (such as BaZrTi 2 O 7 , SrZrTi 2 O 7 , PbZrTi 2 O 7 , etc.) that may form solid solution with CaZrTi 2 O 7 in actual Synroc-based nuclear waste forms. Based on obtained linear free energy relationships, it is predicted that large cations (e.g., Ba and Ra) prefer to be in perovskite structure, and small cations (e.g., Ca, Zn, and Cd) prefer to be in zirconolite structure. (orig.)

  15. Equilibrium modeling of gasification: Gibbs free energy minimization approach and its application to spouted bed and spout-fluid bed gasifiers

    International Nuclear Information System (INIS)

    Jarungthammachote, S.; Dutta, A.

    2008-01-01

    Spouted beds have been found in many applications, one of which is gasification. In this paper, the gasification processes of conventional and modified spouted bed gasifiers were considered. The conventional spouted bed is a central jet spouted bed, while the modified spouted beds are circular split spouted bed and spout-fluid bed. The Gibbs free energy minimization method was used to predict the composition of the producer gas. The major six components, CO, CO 2 , CH 4 , H 2 O, H 2 and N 2 , were determined in the mixture of the producer gas. The results showed that the carbon conversion in the gasification process plays an important role in the model. A modified model was developed by considering the carbon conversion in the constraint equations and in the energy balance calculation. The results from the modified model showed improvements. The higher heating values (HHV) were also calculated and compared with the ones from experiments. The agreements of the calculated and experimental values of HHV, especially in the case of the circular split spouted bed and the spout-fluid bed were observed

  16. Sublime Imperfections : Annotated Reading List

    NARCIS (Netherlands)

    Rutten, E.

    2016-01-01

    In this reading list, I share thoughts on scholars and journalists from which the Sublime Imperfections project takes its inspiration. The authors of the texts that I clustered ponder the nexus between the imperfect and the sublime, they rethink repair and breakdown, they critically interrogate and

  17. Modelling Sublimation of Carbon Dioxide

    Science.gov (United States)

    Winkel, Brian

    2012-01-01

    In this article, the author reports results in their efforts to model sublimation of carbon dioxide and the associated kinetics order and parameter estimation issues in their model. They have offered the reader two sets of data and several approaches to determine the rate of sublimation of a piece of solid dry ice. They presented several models…

  18. Los cuerpos sublimes

    Directory of Open Access Journals (Sweden)

    Juan Pablo Zangara

    2015-09-01

    Full Text Available La narración de crímenes en la prensa de masas y las pantallas parece constituir una versión contemporánea del magnetismo según Edgar Allan Poe. La estetización mediática (ya no la información de una serie reciente de feminicidios permite reconocer una cierta lógica de lo sublime como clave de la producción de noticias-mercancías. En su variante clásica, la ficción policial funciona como una matriz ideológica decisiva de la enunciación periodística.

  19. Sublimation From Snow in Northern Environments

    Science.gov (United States)

    Pomeroy, J. W.

    2002-12-01

    Sublimation from snow is an often neglected component of water and energy balances. Research under the Mackenzie GEWEX Study has attempted to understand the snow and atmospheric processes controlling sublimation and to estimate the magnitude of sublimation in high latitude catchments. Eddy correlation units were used to measure vertical water vapour fluxes from a high latitude boreal forest, snow-covered tundra and shrub-covered tundra in Wolf Creek Research Basin, near Whitehorse Yukon, Territory Canada. Over Jan-Apr. water vapour fluxes from the forest canopy amounted to 18.3 mm, a significant loss from winter snowfall of 54 mm. Most of this loss occurred when the canopy was snow-covered. The weight of snow measured on a suspended, weighed tree indicates that this flux is dominated by sublimation of intercepted snow. In the melt period (April), water vapour fluxes were uniformly small ranging from 0.21 mm/day on the tundra slope, 0.23 mm/day for the forest and 0.27 mm/day for the shrub-tundra. During the melt period the forest and shrub canopies was snow-free and roots were frozen, so the primary source of water vapour from all sites was the surface snow.

  20. Nietzsche's View of Sublimation in the Educational Process

    Science.gov (United States)

    Sharp, Ann Margaret

    1975-01-01

    Article outlined Nietzsche's beliefs on the primary aim of education, the conscious production of the free man through the process of sublimation, the active redirecting of one's life energy in the service of creativity. (Editor/RK)

  1. Measured and modelled sublimation on the tropical Glaciar Artesonraju, Perú

    OpenAIRE

    M. Winkler; I. Juen; T. Mölg; G. Kaser

    2008-01-01

    Sublimation plays a decisive role in the surface energy balance of tropical glaciers. During the dry season low specific humidity and high surface roughness favour the direct transition from ice to vapour and drastically reduce the energy available for melting. However, field measurements are scarce and little is known about the performance of sublimation parametrisations in glacier mass balance and runoff models.

    During 15 days in August 2005 sublimation was measured on ...

  2. Sublime Views and Beautiful Explanations

    DEFF Research Database (Denmark)

    Barry, Daved; Meisiek, Stefan; Hatch, Mary Jo

    To create a generative theory that provides beautiful explanations and sublime views requires both a crafts and an art approach to scientific theorizing. The search for generativity leads scholars to perform various theorizing moves between the confines of simple, yet eloquent beauty...

  3. Numerical implementation and oceanographic application of the Gibbs potential of ice

    Directory of Open Access Journals (Sweden)

    R. Feistel

    2005-01-01

    Full Text Available The 2004 Gibbs thermodynamic potential function of naturally abundant water ice is based on much more experimental data than its predecessors, is therefore significantly more accurate and reliable, and for the first time describes the entire temperature and pressure range of existence of this ice phase. It is expressed in the ITS-90 temperature scale and is consistent with the current scientific pure water standard, IAPWS-95, and the 2003 Gibbs potential of seawater. The combination of these formulations provides sublimation pressures, freezing points, and sea ice properties covering the parameter ranges of oceanographic interest. This paper provides source code examples in Visual Basic, Fortran and C++ for the computation of the Gibbs function of ice and its partial derivatives. It reports the most important related thermodynamic equations for ice and sea ice properties.

  4. Determination of standard Gibbs free energy of formation for Ca2P2O7 and Ca(PO3)2 from solid-state EMF measurements using yttria stabilised zirconia as solid electrolyte

    International Nuclear Information System (INIS)

    Sandstroem, Malin Hannah; Bostroem, Dan; Rosen, Erik

    2006-01-01

    The equilibrium reactions: 3Ca 2 P 2 O 7 (s)+6Ni(s)-bar 2Ca 3 (PO 4 ) 2 (s)+2Ni 3 P(s)+52O 2 (g) and 2Ca(PO 3 ) 2 (s)+6Ni(s)-bar Ca 2 P 2 O 7 (s)+2Ni 3 P(s)+52O 2 (g) were studied in the temperature range 890K to 1140K. The oxygen equilibrium pressures were determined using galvanic cells incorporating yttria stabilized zirconia as solid electrolyte. From the measured data and using the literature values of standard Gibbs free energy of formation for Ca 3 (PO 4 ) 2 and Ni 3 P, the following relationship of the standard Gibbs free energy of formation for Ca 2 P 2 O 7 and Ca(PO 3 ) 2 were calculated:Δ f G o (Ca 2 P 2 O 7 )+/-11/(kJ.mol -1 )=-3475.9+1.5441(T/K)-0.1051(T/K).ln(T/K)andΔ f G o (Ca(PO 3 ) 2 )+/-12/(kJ.mol -1 )=-3334.8+6.1561(T/K)-0.6950(T/K).ln(T/K)

  5. The Sublime in churches and mosques

    NARCIS (Netherlands)

    Doudouh, N.; van Ginderen, S.

    2012-01-01

    Fear gives us the ability to experience the sublime in various situations when we talk about the sublime in architecture.According to Edmund Burke what causes this fear on a person, is darkness and vastness. Can it be that places of worship have been built for the purpose of expressing the sublime?

  6. Quantum Gibbs Samplers: The Commuting Case

    Science.gov (United States)

    Kastoryano, Michael J.; Brandão, Fernando G. S. L.

    2016-06-01

    We analyze the problem of preparing quantum Gibbs states of lattice spin Hamiltonians with local and commuting terms on a quantum computer and in nature. Our central result is an equivalence between the behavior of correlations in the Gibbs state and the mixing time of the semigroup which drives the system to thermal equilibrium (the Gibbs sampler). We introduce a framework for analyzing the correlation and mixing properties of quantum Gibbs states and quantum Gibbs samplers, which is rooted in the theory of non-commutative {mathbb{L}_p} spaces. We consider two distinct classes of Gibbs samplers, one of them being the well-studied Davies generator modelling the dynamics of a system due to weak-coupling with a large Markovian environment. We show that their spectral gap is independent of system size if, and only if, a certain strong form of clustering of correlations holds in the Gibbs state. Therefore every Gibbs state of a commuting Hamiltonian that satisfies clustering of correlations in this strong sense can be prepared efficiently on a quantum computer. As concrete applications of our formalism, we show that for every one-dimensional lattice system, or for systems in lattices of any dimension at temperatures above a certain threshold, the Gibbs samplers of commuting Hamiltonians are always gapped, giving an efficient way of preparing the associated Gibbs states on a quantum computer.

  7. Enthalpies of sublimation of fullerenes by thermogravimetry

    Energy Technology Data Exchange (ETDEWEB)

    Martínez-Herrera, Melchor; Campos, Myriam; Torres, Luis Alfonso; Rojas, Aarón, E-mail: arojas@cinvestav.mx

    2015-12-20

    Graphical abstract: - Highlights: • Enthalpies of sublimation of fullerenes were measured by thermogravimetry. • Results of enthalpies of sublimation are comparable with data reported in literature. • Not previously reported enthalpy of sublimation of C{sub 78} is supplied in this work. • Enthalpies of sublimation show a strong dependence with the number of carbon atoms in the cluster. • Enthalpies of sublimation are congruent with dispersion forces ruling cohesion of solid fullerene. - Abstract: The enthalpies of sublimation of fullerenes, as measured in the interval of 810–1170 K by thermogravimetry and applying the Langmuir equation, are reported. The detailed experimental procedure and its application to fullerenes C{sub 60}, C{sub 70}, C{sub 76}, C{sub 78} and C{sub 84} are supplied. The accuracy and uncertainty associated with the experimental results of the enthalpy of sublimation of these fullerenes show that the reliability of the measurements is comparable to that of other indirect high-temperature methods. The results also indicate that the enthalpy of sublimation increases proportionally to the number of carbon atoms in the cluster but there is also a strong correlation between the enthalpy of sublimation and the polarizability of each fullerene.

  8. Geometric and Texture Inpainting by Gibbs Sampling

    DEFF Research Database (Denmark)

    Gustafsson, David Karl John; Pedersen, Kim Steenstrup; Nielsen, Mads

    2007-01-01

    . In this paper we use the well-known FRAME (Filters, Random Fields and Maximum Entropy) for inpainting. We introduce a temperature term in the learned FRAME Gibbs distribution. By sampling using different temperature in the FRAME Gibbs distribution, different contents of the image are reconstructed. We propose...... a two step method for inpainting using FRAME. First the geometric structure of the image is reconstructed by sampling from a cooled Gibbs distribution, then the stochastic component is reconstructed by sample froma heated Gibbs distribution. Both steps in the reconstruction process are necessary...

  9. Schopenhauer, Nietzsche, and the Aesthetically Sublime

    Science.gov (United States)

    Vandenabeele, Bart

    2003-01-01

    Much has been written on the relationship between Arthur Schopenhauer and Friedrich Nietzsche. Much remains to be said, however, concerning their respective theories of the sublime. In this article, the author first argues against the traditional, dialectical view of Schopenhauer's theory of the sublime that stresses the crucial role the sublime…

  10. Sacred Space and Sublime Sacramental Piety

    DEFF Research Database (Denmark)

    Petersen, Nils Holger

    2012-01-01

    Analyses and Discussions of Mozart's Sacramental Litanies K. 125 and K. 243 in relation to the notions of the Sacred and the Sublime.......Analyses and Discussions of Mozart's Sacramental Litanies K. 125 and K. 243 in relation to the notions of the Sacred and the Sublime....

  11. Measured and modelled sublimation on the tropical Glaciar Artesonraju, Perú

    OpenAIRE

    Winkler , M.; Juen , I.; Mölg , T.; Wagnon , Patrick; Gómez , J.; Kaser , G.

    2009-01-01

    Sublimation plays a decisive role in the surface energy and mass balance of tropical glaciers. During the dry season (May–September) low specific humidity and high surface roughness favour the direct transition from ice to vapour and drastically reduce the energy available for melting. However, field measurements are scarce and little is known about the performance of sublimation parameterisations in glacier mass balance and runoff models.

    During 15 days in August 2005 su...

  12. Surface and snowdrift sublimation at Princess Elisabeth station, East Antarctica

    Directory of Open Access Journals (Sweden)

    W. Thiery

    2012-08-01

    Full Text Available In the near-coastal regions of Antarctica, a significant fraction of the snow precipitating onto the surface is removed again through sublimation – either directly from the surface or from drifting snow particles. Meteorological observations from an Automatic Weather Station (AWS near the Belgian research station Princess Elisabeth in Dronning Maud Land, East-Antarctica, are used to study surface and snowdrift sublimation and to assess their impacts on both the surface mass balance and the surface energy balance during 2009 and 2010. Comparison to three other AWSs in Dronning Maud Land with 11 to 13 yr of observations shows that sublimation has a significant influence on the surface mass balance at katabatic locations by removing 10–23% of their total precipitation, but at the same time reveals anomalously low surface and snowdrift sublimation rates at Princess Elisabeth (17 mm w.e. yr−1 compared to 42 mm w.e. yr−1 at Svea Cross and 52 mm w.e. yr−1 at Wasa/Aboa. This anomaly is attributed to local topography, which shields the station from strong katabatic influence, and, therefore, on the one hand allows for a strong surface inversion to persist throughout most of the year and on the other hand causes a lower probability of occurrence of intermediately strong winds. This wind speed class turns out to contribute most to the total snowdrift sublimation mass flux, given its ability to lift a high number of particles while still allowing for considerable undersaturation.

  13. Gibbs energies of protonation and complexation of platinum and vanadate metal ions with naringenin and phenolic acids: Theoretical calculations associated with experimental values

    International Nuclear Information System (INIS)

    Fazary, Ahmed E.; Alshihri, Ayed S.; Alfaifi, Mohammad Y.; Saleh, Kamel A.; Elbehairi, Serag Eldin I.; Fawy, Khaled F.; Abd-Rabboh, Hisham S.M.

    2016-01-01

    Highlights: • The experimental thermodynamic equilibrium and stability constants of vanadium and platinum complexes involving naringin, ferulic acid, p-coumaric acid, caffeic acid, vanillic acid, sinapic acid, and gallic acid were determined. • The theoretical calculations of the free energy changes associated with the ligand protonation, and metal ion–ligand complex formation equilibria using density function theory calculations, providing a complete picture of the microscopic equilibria of the studied complex systems. - Abstract: The Experimental thermodynamic equilibrium (pK_a values) and stability (log β) constants of vanadium and platinum binary and mixed ligand complexes involving naringenin, ferulic acid, p-coumaric acid, caffeic acid, vanillic acid, sinapic acid, and gallic acid were determined at 310.15 K in 0.16 mol·dm"−"3 KCl aqueous solutions using pH-potentiometric technique and by means of two estimation models (HYPERQUAD 2008 and Bjerrum–Calvin). The theoretical calculations of overall protonation and stability constants of the metal complex species in solution were predicted as the free energy change associated with the ligand protonation, and metal ion–ligand complex formation equilibria (species solvation/de-solvation) using ab initio and density function theory (DFT) calculations. The usage of the experimental potentiometry technique and theoretical predictions provides a complete picture of the microscopic equilibria of the studied systems (vanadium/platinum–naringenin–phenolic acid). Specifically, this theoretically DFT predications would be useful to determine the most real protonation constants of the studied bioligands in which the binding sites changes due to the ligand protonation/deprotonation equilibria. Also, the complexing capacities of vanadium and platinum towards naringenin, ferulic acid, p-coumaric acid, caffeic acid, vanillic acid, sinapic acid, and gallic acid in solutions were evaluated and discussed. From the

  14. Gibbs' theorem for open systems with incomplete statistics

    International Nuclear Information System (INIS)

    Bagci, G.B.

    2009-01-01

    Gibbs' theorem, which is originally intended for canonical ensembles with complete statistics has been generalized to open systems with incomplete statistics. As a result of this generalization, it is shown that the stationary equilibrium distribution of inverse power law form associated with the incomplete statistics has maximum entropy even for open systems with energy or matter influx. The renormalized entropy definition given in this paper can also serve as a measure of self-organization in open systems described by incomplete statistics.

  15. Extension of Gibbs-Duhem equation including influences of external fields

    Science.gov (United States)

    Guangze, Han; Jianjia, Meng

    2018-03-01

    Gibbs-Duhem equation is one of the fundamental equations in thermodynamics, which describes the relation among changes in temperature, pressure and chemical potential. Thermodynamic system can be affected by external field, and this effect should be revealed by thermodynamic equations. Based on energy postulate and the first law of thermodynamics, the differential equation of internal energy is extended to include the properties of external fields. Then, with homogeneous function theorem and a redefinition of Gibbs energy, a generalized Gibbs-Duhem equation with influences of external fields is derived. As a demonstration of the application of this generalized equation, the influences of temperature and external electric field on surface tension, surface adsorption controlled by external electric field, and the derivation of a generalized chemical potential expression are discussed, which show that the extended Gibbs-Duhem equation developed in this paper is capable to capture the influences of external fields on a thermodynamic system.

  16. Unifying hydrotropy under Gibbs phase rule.

    Science.gov (United States)

    Shimizu, Seishi; Matubayasi, Nobuyuki

    2017-09-13

    The task of elucidating the mechanism of solubility enhancement using hydrotropes has been hampered by the wide variety of phase behaviour that hydrotropes can exhibit, encompassing near-ideal aqueous solution, self-association, micelle formation, and micro-emulsions. Instead of taking a field guide or encyclopedic approach to classify hydrotropes into different molecular classes, we take a rational approach aiming at constructing a unified theory of hydrotropy based upon the first principles of statistical thermodynamics. Achieving this aim can be facilitated by the two key concepts: (1) the Gibbs phase rule as the basis of classifying the hydrotropes in terms of the degrees of freedom and the number of variables to modulate the solvation free energy; (2) the Kirkwood-Buff integrals to quantify the interactions between the species and their relative contributions to the process of solubilization. We demonstrate that the application of the two key concepts can in principle be used to distinguish the different molecular scenarios at work under apparently similar solubility curves observed from experiments. In addition, a generalization of our previous approach to solutes beyond dilution reveals the unified mechanism of hydrotropy, driven by a strong solute-hydrotrope interaction which overcomes the apparent per-hydrotrope inefficiency due to hydrotrope self-clustering.

  17. From slump loss to Gibbs' free energy

    DEFF Research Database (Denmark)

    Jensen, Ole Mejlhede; Diamond, Sidney

    2006-01-01

    In its classical form, the science of construction materials is a descriptive, empirical discipline related to certain types of materials, e.g. the study of the properties of wood, steel, concrete and plastics. This traditional division of the science into the separate study of the different...

  18. Notes on the development of the gibbs potential; Sur le developpement du potentiel de gibbs

    Energy Technology Data Exchange (ETDEWEB)

    Bloch, C; Dominicis, C de [Commissariat a l' Energie Atomique, Saclay (France).Centre d' Etudes Nucleaires

    1959-07-01

    A short account is given of some recent work on the perturbation expansion of the Gibbs potential of quantum statistical mechanics. (author) [French] Expose en resume de quelques travaux sur le developpement dans la theorie des perturbations du potentiel de Gibbs de la Mecanique Statistique. (auteur)

  19. Schopenhauer e os paradoxos do sublime

    Directory of Open Access Journals (Sweden)

    François Arnaud

    2012-08-01

    Full Text Available http://dx.doi.org/10.5007/1677-2954.2012v11nesp1p153 A principal distinção entre a concepção schopenhaueriana e kantiana do sublime reside, segundo este artigo, no fato que o observador, no último caso, deve ser submetido a um perigo apenas possível, enquanto no primeiro caso ele deve ser realmente amedrontado. O principal impulso do sentimento do sublime é de fato, em Schopenhauer, a intervenção da vontade, que deve ser portanto realmente ameaçada. Daí resultam alguns paradoxos e originalidades da teoria do sublime de Schopenhauer, principalmente de um ponto de vista ético, cujos vestígios eu tento seguir.

  20. The enthalpy of sublimation of cubane

    International Nuclear Information System (INIS)

    Bashir-Hashemi, A.; Chickos, James S.; Hanshaw, William; Zhao Hui; Farivar, Behzad S.; Liebman, Joel F.

    2004-01-01

    The sublimation enthalpy of cubane, a key reference material for force field and quantum mechanical computations, was measured by combining the vaporization enthalpy at T = 298.15 K to the sum of the fusion enthalpy measured at T = 405 K and a solid-solid phase transition that occurs at T 394 K. The fusion and solid-solid phase transitions were measured previously. A sublimation enthalpy value of (55.2 ± 2.0) kJ mol -1 at T = 298.15 K was obtained. This value compares quite favorably the value obtained by comparing the sublimation enthalpy of similar substances as a function of their molar masses but is at odds with earlier measurements

  1. The enthalpy of sublimation of cubane

    Energy Technology Data Exchange (ETDEWEB)

    Bashir-Hashemi, A.; Chickos, James S.; Hanshaw, William; Zhao Hui; Farivar, Behzad S.; Liebman, Joel F

    2004-12-15

    The sublimation enthalpy of cubane, a key reference material for force field and quantum mechanical computations, was measured by combining the vaporization enthalpy at T = 298.15 K to the sum of the fusion enthalpy measured at T = 405 K and a solid-solid phase transition that occurs at T 394 K. The fusion and solid-solid phase transitions were measured previously. A sublimation enthalpy value of (55.2 {+-} 2.0) kJ mol{sup -1} at T = 298.15 K was obtained. This value compares quite favorably the value obtained by comparing the sublimation enthalpy of similar substances as a function of their molar masses but is at odds with earlier measurements.

  2. Evolution algebras generated by Gibbs measures

    International Nuclear Information System (INIS)

    Rozikov, Utkir A.; Tian, Jianjun Paul

    2009-03-01

    In this article we study algebraic structures of function spaces defined by graphs and state spaces equipped with Gibbs measures by associating evolution algebras. We give a constructive description of associating evolution algebras to the function spaces (cell spaces) defined by graphs and state spaces and Gibbs measure μ. For finite graphs we find some evolution subalgebras and other useful properties of the algebras. We obtain a structure theorem for evolution algebras when graphs are finite and connected. We prove that for a fixed finite graph, the function spaces have a unique algebraic structure since all evolution algebras are isomorphic to each other for whichever Gibbs measures are assigned. When graphs are infinite graphs then our construction allows a natural introduction of thermodynamics in studying of several systems of biology, physics and mathematics by theory of evolution algebras. (author)

  3. Transient thermal protection of film covering circular aperture by sublimation and weak decomposition

    Energy Technology Data Exchange (ETDEWEB)

    Havstad, Mark A.; Miles, Robin R.; Hsieh, Henry, E-mail: hsieh6@llnl.gov

    2015-03-15

    Highlights: • Precise sublimating layers can provide protection in transient thermal environments. • Sensitivity analysis shows that the uncertainty in properties has modest influence. • It is likely that methane layers are a good choice for IFE targets. - Abstract: Unwanted heating of sensitive surfaces in harsh thermal environments can be prevented by precise application of sacrificial materials such as sublimation layers and pyrolyzing films. The use of sublimation for the protection of circular polyimide membranes subjected to brief (∼100 ms) heating by infrared radiation and hot (6000 K) inert gas convection is analyzed. Selection of sublimation material and sublimation layer and membrane thickness is considered with emphasis on providing sufficient thermal protection yet negligible unwanted material remaining at the end of a specified heating period. Though the analysis here is general, the motivation is protection of the polyimide films covering the laser entrance holes on IFE (inertial fusion energy) hohlraums being injected into the hot gas (xenon) protecting IFE reactor chambers. Both one and two dimensional thermal models are used to develop a robust thermal concept. Sensitivity analyses (SA) methods are exercised to show where the design may be vulnerable and which input parameters have the greatest effect on performance and likelihood of success. For the design and conditions considered, methane sublimating layers are probably preferred over xenon or pentane.

  4. Measured and modelled sublimation on the tropical Glaciar Artesonraju, Perú

    Directory of Open Access Journals (Sweden)

    M. Winkler

    2009-02-01

    Full Text Available Sublimation plays a decisive role in the surface energy and mass balance of tropical glaciers. During the dry season (May–September low specific humidity and high surface roughness favour the direct transition from ice to vapour and drastically reduce the energy available for melting. However, field measurements are scarce and little is known about the performance of sublimation parameterisations in glacier mass balance and runoff models.

    During 15 days in August 2005 sublimation was measured on the tongue of Glaciar Artesonraju (8°58' S, 77°38' W in the Cordillera Blanca, Perú, using simple lysimeters. Indicating a strong dependence on surface roughness, daily totals of sublimation range from 1–3 kg m−2 for smooth to 2–5 kg m−2 for rough conditions. (The 15-day means at that time of wind speed and specific humidity were 4.3 m s−1 and 3.8 g kg−1, respectively.

    Measured sublimation was related to characteristic surface roughness lengths for momentum (zm and for the scalar quantities of temperature and water vapour (zs, using a process-based mass balance model. Input data were provided by automatic weather stations, situated on the glacier tongue at 4750 m a.s.l. and 4810 m a.s.l., respectively. Under smooth conditions the combination zm=2.0 mm and zs=1.0 mm appeared to be most appropriate, for rough conditions zm=20.0 mm and zs=10.0 mm fitted best.

    Extending the sublimation record from April 2004 to December 2005 with the process-based model confirms, that sublimation shows a clear seasonality. 60–90% of the energy available for ablation is consumed by sublimation in the dry season, but only 10–15% in the wet season (October–April. The findings are finally used to evaluate the parameterisation of sublimation in the lower-complexity mass

  5. Measured and modelled sublimation on the tropical Glaciar Artesonraju, Perú

    Science.gov (United States)

    Winkler, M.; Juen, I.; Mölg, T.; Wagnon, P.; Gómez, J.; Kaser, G.

    2009-02-01

    Sublimation plays a decisive role in the surface energy and mass balance of tropical glaciers. During the dry season (May-September) low specific humidity and high surface roughness favour the direct transition from ice to vapour and drastically reduce the energy available for melting. However, field measurements are scarce and little is known about the performance of sublimation parameterisations in glacier mass balance and runoff models. During 15 days in August 2005 sublimation was measured on the tongue of Glaciar Artesonraju (8°58' S, 77°38' W) in the Cordillera Blanca, Perú, using simple lysimeters. Indicating a strong dependence on surface roughness, daily totals of sublimation range from 1-3 kg m-2 for smooth to 2-5 kg m-2 for rough conditions. (The 15-day means at that time of wind speed and specific humidity were 4.3 m s-1 and 3.8 g kg-1, respectively.) Measured sublimation was related to characteristic surface roughness lengths for momentum (zm) and for the scalar quantities of temperature and water vapour (zs), using a process-based mass balance model. Input data were provided by automatic weather stations, situated on the glacier tongue at 4750 m a.s.l. and 4810 m a.s.l., respectively. Under smooth conditions the combination zm=2.0 mm and zs=1.0 mm appeared to be most appropriate, for rough conditions zm=20.0 mm and zs=10.0 mm fitted best. Extending the sublimation record from April 2004 to December 2005 with the process-based model confirms, that sublimation shows a clear seasonality. 60-90% of the energy available for ablation is consumed by sublimation in the dry season, but only 10-15% in the wet season (October-April). The findings are finally used to evaluate the parameterisation of sublimation in the lower-complexity mass balance model ITGG, which has the advantage of requiring precipitation and air temperature as only input data. It turns out that the implementation of mean wind speed is a possible improvement for the representation of

  6. "Back-fire to lust": G. Stanley Hall, sex-segregated schooling, and the engine of sublimation.

    Science.gov (United States)

    Graebner, William

    2006-08-01

    G. Stanley Hall was an advocate of sex-segregated schooling long after most Americans had accepted coeducation. His position was based in part on personal experience: observations of his father and mother, a repressed and guilt-ridden boyhood sexuality, and his conviction that his own career success was a product of sublimated sexual desire, of erotic energy converted into mental energy. Hall theorized that coeducation put sublimation at risk, and that sex-segregated schools, by contributing to proper gendered development and by prolonging and sublimating the sexual tensions of adolescence, would produce social progress.

  7. Recommended sublimation pressure and enthalpy of benzene

    Czech Academy of Sciences Publication Activity Database

    Růžička, K.; Fulem, Michal; Červinka, C.

    2014-01-01

    Roč. 68, Jan (2014), s. 40-47 ISSN 0021-9614 Institutional support: RVO:68378271 Keywords : benzene * vapor pressure * heat capacity * ideal - gas thermodynamic properties * sublimation enthalpy * recommended vapor pressure Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 2.679, year: 2014

  8. Generalization of Gibbs Entropy and Thermodynamic Relation

    OpenAIRE

    Park, Jun Chul

    2010-01-01

    In this paper, we extend Gibbs's approach of quasi-equilibrium thermodynamic processes, and calculate the microscopic expression of entropy for general non-equilibrium thermodynamic processes. Also, we analyze the formal structure of thermodynamic relation in non-equilibrium thermodynamic processes.

  9. Finite Cycle Gibbs Measures on Permutations of

    Science.gov (United States)

    Armendáriz, Inés; Ferrari, Pablo A.; Groisman, Pablo; Leonardi, Florencia

    2015-03-01

    We consider Gibbs distributions on the set of permutations of associated to the Hamiltonian , where is a permutation and is a strictly convex potential. Call finite-cycle those permutations composed by finite cycles only. We give conditions on ensuring that for large enough temperature there exists a unique infinite volume ergodic Gibbs measure concentrating mass on finite-cycle permutations; this measure is equal to the thermodynamic limit of the specifications with identity boundary conditions. We construct as the unique invariant measure of a Markov process on the set of finite-cycle permutations that can be seen as a loss-network, a continuous-time birth and death process of cycles interacting by exclusion, an approach proposed by Fernández, Ferrari and Garcia. Define as the shift permutation . In the Gaussian case , we show that for each , given by is an ergodic Gibbs measure equal to the thermodynamic limit of the specifications with boundary conditions. For a general potential , we prove the existence of Gibbs measures when is bigger than some -dependent value.

  10. Gibbs equilibrium averages and Bogolyubov measure

    International Nuclear Information System (INIS)

    Sankovich, D.P.

    2011-01-01

    Application of the functional integration methods in equilibrium statistical mechanics of quantum Bose-systems is considered. We show that Gibbs equilibrium averages of Bose-operators can be represented as path integrals over a special Gauss measure defined in the corresponding space of continuous functions. We consider some problems related to integration with respect to this measure

  11. Alan Paton's Sublime: Race, Landscape and the Transcendence of ...

    African Journals Online (AJOL)

    This article develops a postcolonial reading of the sublime by suggesting that aesthetic theories of the sublime were, in their classical philosophical formulations by Edmund Burke and Immanuel Kant, founded on problematic assumptions of racial difference. In the colonial sphere, it is argued, the sublime could discursively ...

  12. Mechanism and kinetics for ammonium dinitramide (ADN) sublimation: a first-principles study.

    Science.gov (United States)

    Zhu, R S; Chen, Hui-Lung; Lin, M C

    2012-11-08

    The mechanism for sublimation of NH(4)N(NO(2))(2) (ADN) has been investigated quantum-mechanically with generalized gradient approximation plane-wave density functional theory calculations; the solid surface is represented by a slab model and the periodic boundary conditions are applied. The calculated lattice constants for the bulk ADN, which were found to consist of NH(4)(+)[ON(O)NNO(2)](-) units, instead of NH(4)(+)[N(NO(2))(2)](-), agree quite well with experimental values. Results show that three steps are involved in the sublimation/decomposition of ADN. The first step is the relaxation of the surface layer with 1.6 kcal/mol energy per NH(4)ON(O)NNO(2) unit; the second step is the sublimation of the surface layer to form a molecular [NH(3)]-[HON(O)NNO(2)] complex with a 29.4 kcal/mol sublimation energy, consistent with the experimental observation of Korobeinichev et al. (10) The last step is the dissociation of the [H(3)N]-[HON(O)NNO(2)] complex to give NH(3) and HON(O)NNO(2) with the dissociation energy of 13.9 kcal/mol. Direct formation of NO(2) (g) from solid ADN costs a much higher energy, 58.3 kcal/mol. Our calculated total sublimation enthalpy for ADN(s) → NH(3)(g) + HON(O)NNO(2)) (g), 44.9 kcal/mol via three steps, is in good agreement with the value, 42.1 kcal/mol predicted for the one-step sublimation process in this work and the value 44.0 kcal/mol computed by Politzer et al. (11) using experimental thermochemical data. The sublimation rate constant for the rate-controlling step 2 can be represented as k(sub) = 2.18 × 10(12) exp (-30.5 kcal/mol/RT) s(-1), which agrees well with available experimental data within the temperature range studied. The high pressure limit decomposition rate constant for the molecular complex H(3)N···HON(O)NNO(2) can be expressed by k(dec) = 3.18 × 10(13) exp (-15.09 kcal/mol/RT) s(-1). In addition, water molecules were found to increase the sublimation enthalpy of ADN, contrary to that found in the ammonium

  13. The enthalpy of sublimation and thermodynamic functions of fermium

    International Nuclear Information System (INIS)

    Haire, R.G.; Gibson, J.K.

    1989-01-01

    The enthalpy of sublimation of fermium (Fm), element 100, has now been determined directly by measuring the partial pressure of Fm over alloys, for the temperature range of 642 to 905 K. The partial pressures were determined using Knudsen effusion and target collection techniques. Dilute (10 -5 --10 -7 atom %) solid alloys of Fm and mixtures of Fm and Es in both Sm and Yb solvents were studied. The presence of Es in two of the alloys allowed a direct comparison of the behavior of Fm and Es, where the latter could be used as a reference. It was possible to calculate enthalpies of sublimation and a hypothetical vapor pressure/temperature relationship for pure Fm metal by selecting Yb as the solvent most likely to form a nearly ideal alloy with Fm. From the experimental vapor pressure data, we derived average Second Law values of 33.8±3 kcal/mol and 23.5±3 cal/mol deg for the enthalpy and entropy of sublimation of Fm at 298 K. Third Law enthalpy values were also calculated using the experimental partial pressure data and entropies estimated from derived free energy functions and heat capacities for the solid and gaseous forms of Fm. The average Third Law values (34.8 kcal/mol and 25.1 cal/mol deg, respectively, at 298 K) are in agreement with those obtained via the Second Law. These results establish that Fm, like Es (element 99), is a divalent metal. The finding that Fm metal is the second divalent actinide element experimentally establishes the trend towards metallic divalency expected in the second half of the actinide series

  14. Freezer-sublimer for gaseous diffusion plant

    International Nuclear Information System (INIS)

    Reti, G.R.

    1978-01-01

    A method and apparatus is disclosed for freezing and subliming uranium hexafluoride (UF 6 ) as part of a gaseous diffusion plant from which a quantity of the UF 6 inventory is intermittently withdrawn and frozen to solidify it. A plurality of upright heat pipes holds a coolant and is arranged in a two compartment vessel, the lower compartment is exposed to UF 6 , the higher one serves for condensing the evaporated coolant by means of cooling water. In one embodiment, each pipe has a quantity of coolant such as freon, hermetically sealded therein. In the other embodiment, each pipe is sealed only at the lower end while the upper end communicates with a common vapor or cooling chamber which contains a water cooled condenser. The cooling water has a sufficiently low temperature to condense the evaporated coolant. The liquid coolant flows gravitationally downward to the lower end portion of the pipe. UF 6 gas is flowed into the tank where it contacts the finned outside surface of the heat pipes. Heat from the gas evaporates the coolant and the gas in turn is solidified on the exterior of the heat pipe sections in the tank. To recover UF 6 gas from the tank, the solidified UF 6 is sublimed by passing compressed UF 6 gas over the frozen UF 6 gas on the pipes or by externally heating the lower ends of the pipes sufficiently to evaporate the coolant therein above the subliming temperature of the UF 6 . The subliming UF 6 gas then condenses the coolant in the vertical heat pipes, so that it can gravitationally flow back to the lower end portions

  15. Art, Terrorism and the Negative Sublime

    Directory of Open Access Journals (Sweden)

    Arnold Berleant

    2009-01-01

    Full Text Available The range of the aesthetic has expanded to cover not only a wider range of objects and situations of daily life but also to encompass the negative. This includes terrorism, whose aesthetic impact is central to its use as a political tactic. The complex of positive and negative aesthetic values in terrorism are explored, introducing the concept of the sublime as a negative category to illuminate the analysis and the distinctive aesthetic of terrorism.

  16. Rare earths refining by vacuum sublimation method

    International Nuclear Information System (INIS)

    Rytus, N.N.

    1983-01-01

    The process of rare earths refining by the sUblimation; method in high and superhigh oil-free vacuum, is investigated. The method is effective for rare earths obtaining and permits to prepare metal samples with a high value of electric resistance ratio γ=RsUb(298 K)/Rsub(4.2 K). The estimation of general purity is performed for Sm, Eu, Yb, Tm, Dy, Ho, Er and Se

  17. Gibbs sampling on large lattice with GMRF

    Science.gov (United States)

    Marcotte, Denis; Allard, Denis

    2018-02-01

    Gibbs sampling is routinely used to sample truncated Gaussian distributions. These distributions naturally occur when associating latent Gaussian fields to category fields obtained by discrete simulation methods like multipoint, sequential indicator simulation and object-based simulation. The latent Gaussians are often used in data assimilation and history matching algorithms. When the Gibbs sampling is applied on a large lattice, the computing cost can become prohibitive. The usual practice of using local neighborhoods is unsatisfying as it can diverge and it does not reproduce exactly the desired covariance. A better approach is to use Gaussian Markov Random Fields (GMRF) which enables to compute the conditional distributions at any point without having to compute and invert the full covariance matrix. As the GMRF is locally defined, it allows simultaneous updating of all points that do not share neighbors (coding sets). We propose a new simultaneous Gibbs updating strategy on coding sets that can be efficiently computed by convolution and applied with an acceptance/rejection method in the truncated case. We study empirically the speed of convergence, the effect of choice of boundary conditions, of the correlation range and of GMRF smoothness. We show that the convergence is slower in the Gaussian case on the torus than for the finite case studied in the literature. However, in the truncated Gaussian case, we show that short scale correlation is quickly restored and the conditioning categories at each lattice point imprint the long scale correlation. Hence our approach enables to realistically apply Gibbs sampling on large 2D or 3D lattice with the desired GMRF covariance.

  18. An efficient estimator for Gibbs random fields

    Czech Academy of Sciences Publication Activity Database

    Janžura, Martin

    2014-01-01

    Roč. 50, č. 6 (2014), s. 883-895 ISSN 0023-5954 R&D Projects: GA ČR(CZ) GBP402/12/G097 Institutional support: RVO:67985556 Keywords : Gibbs random field * efficient estimator * empirical estimator Subject RIV: BA - General Mathematics Impact factor: 0.541, year: 2014 http://library.utia.cas.cz/separaty/2015/SI/janzura-0441325.pdf

  19. Reassessing Aesthetic Appreciation of Nature in the Kantian Sublime

    Science.gov (United States)

    Brady, Emily

    2012-01-01

    The sublime has been a relatively neglected topic in recent work in philosophical aesthetics, with existing discussions confined mainly to problems in Kant's theory. Given the revival of interest in his aesthetic theory and the influence of the Kantian sublime compared to other eighteenth-century accounts, this focus is not surprising. Kant's…

  20. Por uma metafísica do sublime

    Directory of Open Access Journals (Sweden)

    Martha de Almeida

    2009-12-01

    Full Text Available The sublime has been analyzed since ancient times with a striking compared with tragedy, whether as a literary genre, whether through Poetics, Aristotle's catharsis we translate the feeling the sublime. In modernity, new names were coming to work with this theory: Hume himself, in his essay The Tragedy, was impressed by the ability of this art form has to produce such strong effects on the viewer. But who else has strengthened analysis of the sublime in modernity, providing the basis for their own Kant was Edmund Burke, with his piece A philosophical investigation on the ideas of the sublime and the beautiful. The third criticism of Kant devoted a special moment to the analysis of the sublime, which had served as basis also for Schopenhauer, however, from her built his own aesthetic that would be of paramount importance Nieztsche for the young, mainly due to the consideration of music as sublime art. Nietzsche, then built his tragic wisdom, with based on the experience of the sublime tragedy.The question this paper wants to treat it exactly: It is possible think of a metaphysics of the sublime, based on Nietzsche?

  1. The Sublime, Ugliness and Contemporary Art: A Kantian Perspective

    Directory of Open Access Journals (Sweden)

    Mojca Kuplen

    2015-06-01

    Full Text Available The aim of this paper is twofold. First, to explain the distinction between Kant’s notions of the sublime and ugliness, and to answer an important question that has been left unnoticed in contemporary studies, namely why it is the case that even though both sublime and ugliness are contrapurposive for the power of judgment, occasioning the feeling of displeasure, yet that after all we should feel pleasure in the former, while not in the latter. Second, to apply my interpretation of the sublime and ugliness to contemporary art, and to resolve certain issues that have been raised in accounting for the possibility of artistic sublimity. I argue that an experience of a genuine artistic sublimity is an uncommon occurrence. I propose that the value of contemporary art can be best explained by referring to Kant’s notion of ugliness and his theory of aesthetic ideas.

  2. Sublime science: Teaching for scientific sublime experiences in middle school classrooms

    Science.gov (United States)

    Cavanaugh, Shane

    Due to a historical separation of cognition and emotion, the affective aspects of learning are often seen as trivial in comparison to the more 'essential' cognitive qualities - particularly in the domain of science. As a result of this disconnect, feelings of awe, wonder, and astonishment as well as appreciation have been largely ignored in the working lives of scientists. In turn, I believe that science education has not accurately portrayed the world of science to our students. In an effort to bring the affective qualities of science into the science classroom, I have drawn on past research in the field of aesthetic science teaching and learning as well as works by, Burke, Kant, and Dewey to explore a new construct I have called the "scientific sublime". Scientific sublime experiences represent a sophisticated treatment of the cognitive as well as affective qualities of science learning. The scientific sublime represents feelings of awe, wonder, and appreciation that come from a deep understanding. It is only through this understanding of a phenomenon that we can appreciate its true complexity and intricacies, and these understandings when mixed with the emotions of awe and reverence, are sublime. Scientific sublime experiences are an attempt at the re-integration of cognition and feeling. The goal of this research was twofold: to create and teach a curriculum that fosters scientific sublime experiences in middle school science classes, and to better understand how these experiences are manifested in students. In order to create an approach to teaching for scientific sublime experiences, it was first necessary for me to identify key characteristics of such an experience and a then to create a pedagogical approach, both of which are described in detail in the dissertation. This research was conducted as two studies in two different middle schools. My pedagogical approach was used to create and teach two five-week 7 th grade science units---one on weather

  3. Thermodynamics, Gibbs Method and Statistical Physics of Electron Gases Gibbs Method and Statistical Physics of Electron Gases

    CERN Document Server

    Askerov, Bahram M

    2010-01-01

    This book deals with theoretical thermodynamics and the statistical physics of electron and particle gases. While treating the laws of thermodynamics from both classical and quantum theoretical viewpoints, it posits that the basis of the statistical theory of macroscopic properties of a system is the microcanonical distribution of isolated systems, from which all canonical distributions stem. To calculate the free energy, the Gibbs method is applied to ideal and non-ideal gases, and also to a crystalline solid. Considerable attention is paid to the Fermi-Dirac and Bose-Einstein quantum statistics and its application to different quantum gases, and electron gas in both metals and semiconductors is considered in a nonequilibrium state. A separate chapter treats the statistical theory of thermodynamic properties of an electron gas in a quantizing magnetic field.

  4. Concentration inequalities for functions of Gibbs fields with application to diffraction and random Gibbs measures

    CERN Document Server

    Külske, C

    2003-01-01

    We derive useful general concentration inequalities for functions of Gibbs fields in the uniqueness regime. We also consider expectations of random Gibbs measures that depend on an additional disorder field, and prove concentration w.r.t the disorder field. Both fields are assumed to be in the uniqueness regime, allowing in particular for non-independent disorder field. The modification of the bounds compared to the case of an independent field can be expressed in terms of constants that resemble the Dobrushin contraction coefficient, and are explicitly computable. On the basis of these inequalities, we obtain bounds on the deviation of a diffraction pattern created by random scatterers located on a general discrete point set in the Euclidean space, restricted to a finite volume. Here we also allow for thermal dislocations of the scatterers around their equilibrium positions. Extending recent results for independent scatterers, we give a universal upper bound on the probability of a deviation of the random sc...

  5. Determination of standard Ghibbs free energy of formation of NiW sub 2 B sub 2 and activity of Ni-W binary system by EMF measurement. Kidenryokuho ni yoru NiW sub 2 B sub 2 no hyojun seisei Gibbs jiyu energy to Ni-W 2 seibunkei no katsuryo no sokutei

    Energy Technology Data Exchange (ETDEWEB)

    Kayama, Koichiro; Hashimoto, Yasuhiko; Suzuki, Kenji; Matsuo, Hideki (Himeji Inst. of Tech., Hyogo (Japan) Fukushin Electric Co., Ltd., Hyogo (Japan))

    1989-12-25

    NiW {sub 2} B {sub 2} (M phase), existing in trinary Ni-W-B system, was measured in standard Gibbs free energy (GF) of formation in the temperature range from 1273K to 1423K by an electromotive force method (EMF) with use of solid oxide electrolyte. First, oxide phase in equilibrium with three-phase M-W-Ni solid solution region was confirmed to be B {sub 2} O {sub 3}. Binary Ni-W system solid solution in equilibrium with M phase and W phase is constant in composition with Ni-16.4mo1%W in the above temperature range. WO {sub 2} and WO {sub 2.72} were actually measured in GF. As Ni-W solid solution is in equilibrium with WO {sub 2} and WO {sub 2.72}, binary Ni-W system was measured in activity by the EMF, and Ni-16.4mo1%W solid solution was calculated in GF of mixing by use of the above measured GF of WO {sub 2} and WO {sub 2.72}. Finally with use of sample in M-W-Ni solid solution region, M phase was calculated in GF by the EMF. The result of those calculations were expressed with experimental formulas. 19 refs., 10 figs., 3 tabs.

  6. Sublime frequencies:  The construction of sublime listening experiences in the sonification of scientific data.

    Science.gov (United States)

    Supper, Alexandra

    2014-02-01

    In the past two decades, the sonification of scientific data - an auditory equivalent of data visualization in which data are turned into sounds - has become increasingly widespread, particularly as an artistic practice and as a means of popularizing science. Sonification is thus part of the recent trend, discussed in public understanding of science literature, towards increased emphasis on 'interactivity' and 'crossovers' between science and art as a response to the perceived crisis in the relationship between the sciences and their publics. However, sonification can also be understood as the latest iteration in a long tradition of theorizing the relations between nature, science and human experience. This article analyses the recent public fascination with sonification and argues that sonification grips public imaginations through the promise of sublime experiences. I show how the 'auditory sublime' is constructed through varying combinations of technological, musical and rhetorical strategies. Rather than maintain a singular conception of the auditory sublime, practitioners draw on many scientific and artistic repertoires. However, sound is often situated as an immersive and emotional medium in contrast to the supposedly more detached sense of vision. The public sonification discourse leaves intact this dichotomy, reinforcing the idea that sound has no place in specialist science.

  7. A brief critique of the Adam-Gibbs entropy model

    DEFF Research Database (Denmark)

    Dyre, J. C.; Hecksher, Tina; Niss, Kristine

    2009-01-01

    This paper critically discusses the entropy model proposed by Adam and Gibbs in 1965 for the dramatic temperature dependence of glass-forming liquids' average relaxation time, which is one of the most influential models during the last four decades. We discuss the Adam-Gibbs model's theoretical...

  8. Snowmelt and sublimation: field experiments and modelling in the High Atlas Mountains of Morocco

    Directory of Open Access Journals (Sweden)

    O. Schulz

    2004-01-01

    Full Text Available Snow in the High Atlas Mountains is a major source for freshwater renewal and for water availability in the semi-arid lowlands of south-eastern Morocco. Snowfall- and snow-ablation monitoring and modelling is important for estimating potential water delivery from the mountain water towers to the forelands. This study is part of GLOWA-IMPETUS, an integrated management project dealing with scarce water resources in West Africa. The Ameskar study area is located to the south of the High Atlas Mountains, in their rain shadow. As a part of the M’Goun river basin within the upper Drâa valley, the study area is characterised by high radiation inputs, low atmospheric humidity and long periods with sub-zero temperatures. Its altitude ranges between 2000 m and 4000 m, with dominant north- and south-facing slopes. Snowfall occurs mainly from November to April but even summit regions can become repeatedly devoid of snow cover. Snow cover maps for the M’Goun basin (1240 km2 are derived from calculations of NDSI (Normalized Difference Snow Index from MODIS satellite images and snow depth is monitored at four automatic weather stations between 2000–4000 m. Snowfall events are infrequent at lower altitudes. The presence of snow penitentes at altitudes above 3000 m indicates that snow sublimation is an important component of snow ablation. Snow ablation was modelled with the UEB Utah Energy Balance Model (Tarboton and Luce, 1996. This single layer, physically-based, point energy and mass balance model is driven by meteorological variables recorded at the automatic weather stations at Tounza (2960 m and Tichki (3260 m. Data from snow pillows at Tounza and Tichki are used to validate the model’s physical performance in terms of energy and water balances for a sequence of two snowfall events in the winter of 2003/4. First UEB modelling results show good overall performance and timing of snowmelt and sublimation compared to field investigations. Up to 44

  9. The Religious-Sublime in Music, Literature and Architecture

    DEFF Research Database (Denmark)

    Cifuentes-Aldunate, Claudio

    2018-01-01

    The present article is an attempt to propose the semiotic aspect that produces the ”religious- sublime”. Most of the semiotic characteristics that we use to represent (and produce) the signifiers of the religious-sublime, nevertheless, share their mechanisms with other modalities of ”sublimeness......”. The sublime will be regarded as the representation (in the sense of staging) of a perception. I will propose how the subjective perception – in this case of the divinity - is (re)constructed by the subject in a piece of Spanish Gothic literature, in sacred music and in architecture – the room which houses...

  10. Psychoanalytic Interpretation of Blueberries by Susan Gibb

    Directory of Open Access Journals (Sweden)

    Maya Zalbidea Paniagua

    2014-06-01

    Full Text Available Blueberries (2009 by Susan Gibb, published in the ELO (Electronic Literature Organization, invites the reader to travel inside the protagonist’s mind to discover real and imaginary experiences examining notions of gender, sex, body and identity of a traumatised woman. This article explores the verbal and visual modes in this digital short fiction following semiotic patterns as well as interpreting the psychological states that are expressed through poetical and technological components. A comparative study of the consequences of trauma in the protagonist will be developed including psychoanalytic theories by Sigmund Freud, Jacques Lacan and the feminist psychoanalysts: Melanie Klein and Bracha Ettinger. The reactions of the protagonist will be studied: loss of reality, hallucinations and Electra Complex, as well as the rise of defence mechanisms and her use of the artistic creativity as a healing therapy. The interactivity of the hypermedia, multiple paths and endings will be analyzed as a literary strategy that increases the reader’s capacity of empathizing with the speaker.

  11. Gibbs perturbations of a two-dimensional gauge field

    International Nuclear Information System (INIS)

    Petrova, E.N.

    1981-01-01

    Small Gibbs perturbations of random fields have been investigated up to now for a few initial fields only. Among them there are independent fields, Gaussian fields and some others. The possibility for the investigation of Gibbs modifications of a random field depends essentially on the existence of good estimates for semiinvariants of this field. This is the reason why the class of random fields for which the investigation of Gibbs perturbations with arbitrary potential of bounded support is possible is rather small. The author takes as initial a well-known model: a two-dimensional gauge field. (Auth.)

  12. Some attributes of snow occurrence and snowmelt/sublimation rates ...

    African Journals Online (AJOL)

    Some attributes of snow occurrence and snowmelt/sublimation rates in the Lesotho ... and trimmed MODIS SNOMAP image using the ArcGIS Spatial Analyst tool. ... and hydrology, earth surface processes, and rural livelihoods in the Lesotho ...

  13. Scanning electron microscope observations of sublimates from Merapi Volcano, Indonesia

    Science.gov (United States)

    Symonds, R.

    1993-01-01

    Sublimates were sampled from high-temperature (up to 800??C) fumaroles at Merapi volcano in January 1984. Sampling is accomplished by inserting silica tubes into high-temperature vents. Volcanic glass flows through the tubes and sublimates precipitate on the inner walls in response to the temperature gradient. With decreasing temperature (800-500??C) in the tubes, there are five sublimate zones. Texturally, the sublimate phases grade from large, well-formed crystals at their highest-temperature occurrence to more numerous, smaller crystals that are less perfect at lower temperatures. These changes imply that the crystal nucleation and growth rates increase and decrease, respectively, as temperature decreases. Overall, the textural data suggest that the gas is saturated or slightly super-saturated with the phases at their hottest occurrence, but that the gas becomes increasingly super-saturated with the phases at lower temperatures. -from Author

  14. The Kantian theory of the sublime and humanist politics

    OpenAIRE

    Ayas, Tuğba

    2013-01-01

    Ankara : The Department of Art, Design and Architecture, İhsan Doğramacı Bilkent University, 2013. Thesis (Ph. D.) -- Bilkent University, 2013. Includes bibliographical refences. The German philosopher Immanuel Kant’s rendition of cosmopolitanism and the sublime have been quite popular separately in various discussions on politics and aesthetics since the late 90s. In today’s political conjuncture the Kantian sublime is consulted in describing the social disasters that had b...

  15. O Sublime explicado às crianças

    Directory of Open Access Journals (Sweden)

    Virginia Figueiredo

    2011-01-01

    Full Text Available Como o próprio título indica, este ensaio pretende dialogar com a recepção do sublime kantiano pela filosofia francesa contemporânea, sobretudo com Jean-François Lyotard. Dessa forma, ao invés de ressaltar as consequências inevitável ou sistematicamente morais do sublime kantiano, como fez, de um modo geral, o comentário mais tradicional da filosofia crítica de Kant, este ensaio tenta interpretar o sublime como sendo essencialmente uma experiência da arte, seguindo assim de perto aquela tradição francesa. Mas, ao mesmo tempo, tomando alguma distância, este texto quer fazer uma objeção ao fundamento exclusivamente burkiano da concepção de sublime de Lyotard. Em suma, quero defender que é possível privilegiar o tempo (aspecto central do sublime de Edmund Burke, segundo Lyotard também na experiência do sublime kantiano.

  16. Sublimity and beauty: A view from nursing aesthetics.

    Science.gov (United States)

    Siles-González, José; Solano-Ruiz, Carmen

    2016-03-01

    Several authors have focused on the aesthetics of nursing care from diverse perspectives; however, there are few studies about the sublime and the beautiful in nursing. To identify beautiful and sublime moments in the context of the aesthetics of nursing care. A theoretical reflection has been contemplated about sublime and beautiful values in the context of the aesthetics of nursing care from the cultural history perspective. For that purpose, a revision of this issue has been completed. The terms 'beautiful' and 'sublime' have been analysed to identify the characteristics of both in the context of nursing care. We have followed all ethical requirements regarding the sources, conducting research and authorship. There is no conflict of interest in this paper. With aesthetic knowledge, the nurse expresses the artistic nature of nursing care by appreciating the act of caring for individuals. The sublime is a complex phenomenon, since apparently contrary feelings are interwoven. Nursing care is an art with an anthropological object-subject on which the 'artist' applies their prior knowledge and skills. Feelings and emotions that develop during the clinical nursing practice - especially at times sublime and beautiful, aesthetic - constitute experiences which are professionally significant. © The Author(s) 2015.

  17. Reflections on Gibbs: From Critical Phenomena to the Amistad

    Science.gov (United States)

    Kadanoff, Leo P.

    2003-03-01

    J. Willard Gibbs, the younger was the first American theorist. He was one of the inventors of statistical physics. His introduction and development of the concepts of phase space, phase transitions, and thermodynamic surfaces was remarkably correct and elegant. These three concepts form the basis of different but related areas of physics. The connection among these areas has been a subject of deep reflection from Gibbs' time to our own. I shall talk about these connections by using concepts suggested by the work of Michael Berry and explicitly put forward by the philosopher Robert Batterman. This viewpoint relates theory-connection to the applied mathematics concepts of asymptotic analysis and singular perturbations. J. Willard Gibbs, the younger, had all his achievements concentrated in science. His father, also J. Willard Gibbs, also a Professor at Yale, had one great achievement that remains unmatched in our day. I shall describe it.

  18. Boltzmann, Gibbs and Darwin-Fowler approaches in parastatistics

    International Nuclear Information System (INIS)

    Ponczek, R.L.; Yan, C.C.

    1976-01-01

    Derivations of the equilibrium values of occupation numbers are made using three approaches, namely, the Boltzmann 'elementary' one, the ensemble method of Gibbs, and that of Darwin and Fowler as well [pt

  19. Gibbs phenomenon for dispersive PDEs on the line

    OpenAIRE

    Biondini, Gino; Trogdon, Thomas

    2014-01-01

    We investigate the Cauchy problem for linear, constant-coefficient evolution PDEs on the real line with discontinuous initial conditions (ICs) in the small-time limit. The small-time behavior of the solution near discontinuities is expressed in terms of universal, computable special functions. We show that the leading-order behavior of the solution of dispersive PDEs near a discontinuity of the ICs is characterized by Gibbs-type oscillations and gives exactly the Wilbraham-Gibbs constant.

  20. Standard molar enthalpies of formation and of sublimation of the terphenyl isomers

    International Nuclear Information System (INIS)

    Ribeiro da Silva, Manuel A.V.; Santos, Luis M.N.B.F.; Lima, Luis M. Spencer S.

    2008-01-01

    The standard (p 0 = 0.1 MPa) molar enthalpies of formation in the crystalline phases of ortho, meta and para-terphenyl isomers, at T = 298.15 K, were derived from the standard molar energies of combustion, measured by mini-bomb combustion calorimetry. The Knudsen mass-loss effusion technique was used to measure the dependence of the vapour pressure of the crystals with the temperature, thus deriving their standard molar enthalpies of sublimation by means of the Clausius-Clapeyron equation. Combining the standard molar enthalpies of formation and sublimation of the crystalline terphenyls, the standard molar enthalpies of formation in the gaseous state, at T = 298.15 K, were derived for the three isomers. Results are provided in a table. The results show small but detectable isomerization enthalpies between the terphenyls, indicating the following relative enthalpic stabilities: m- > p- ∼ o-terphenyl

  1. O paradoxo sublime ou a alforria da arte

    Directory of Open Access Journals (Sweden)

    Virgínia Figueiredo

    2015-01-01

    Full Text Available Neste texto, pretendo analisar a tese principal do ensaio “A verdade sublime” de Philippe Lacoue-Labarthe, a qual poderia ser formulada do seguinte modo: a verdade sublime é o Ereignis, esse é o fundamento a partir do qual se desenvolveu uma dificílima operação que consistiu em modificar a tradição do sublime sempre apresentado negativamente naquilo que Lacoue-Labarthe chamou de "compreensão afirmativa do sublime ou da grande arte". O autor estabelece uma astuciosa aliança entre o que há de mais radical no pensamento de Heidegger e o sublime, tratado de maneira bastante polêmica, como a principal teoria da arte de Kant. Dessa articulação fundamental, pode-se concluir que ele não está apenas à procura de uma “Estética” (sequer de uma “Teoria da Arte” sublime, mas, em busca de algo que é muito mais ambicioso, a saber: de um pensamento do sublime. Portanto, na minha opinião, o ensaio lacouelabarthiano constitui, por um lado, uma referência indispensável não só a quem quer que pretenda estudar a tradição do sublime, mas, por outro, compreender o pensamento heideggeriano sobre a arte e sua tentativa de encontrar uma determinação mais essencial e, sobretudo, ousaria dizer, mais política da arte.

  2. Algunas Precisiones en torno a las funciones termodinámicas energía libre de Gibbs

    OpenAIRE

    Solaz Portolés, Joan Josep; Quílez Pardo, Juan

    2001-01-01

    The aim of this study is to elucidate some didactic misundertandings related with the use and the appli cability of the delta functions ∆G, ∆rG and ∆rG0, which derive from the thermodynamic potential Gibbs Free Energy, G.

  3. DEVELOPMENT OF VACUUM SUBLIMATION DRYERS USING THERMOELECTRIC MODULES

    Directory of Open Access Journals (Sweden)

    R. A. Barykin

    2014-01-01

    Full Text Available Summary. The main directions of use of freeze-dryed products and ingredients are revealed. The analysis of sales markets of freeze-dryed products is provided. It is shown that introduction of innovative production technologies will allow to develop dynamically not only to the large companies, but also small firms that will create prerequisites for growth of the Russian market of freeze-dryed products. Tendencies of development of the freeze-drying equipment are analysed. Relevance of development of energy saving freeze-dryers is proved The integrated approach to creation of competitive domestic technologies and the equipment for sublimation dehydration of thermolabile products consists in use of the effective combined remedies of a power supply, a process intensification, reduction of specific energy consumption and, as a result, decrease in product cost at achievement of high quality indicators. Advantages of thermoelectric modules as alternative direction to existing vapor-compression and absorbing refrigerating appliances are given. Researches of process of freeze-drying dehydration with use of thermoelectric modules are conducted. It is scientifically confirmed, that the thermoelectric module working at Peltier effect, promotes increase in refrigerating capacity due to use of the principle of the thermal pump. Options of use of thermoelectric modules in designs of dryers are offered. Optimum operating modes and number of modules in section are defined. Ways of increase of power efficiency of freeze-dryers with use of thermoelectric modules are specified. The received results will allow to make engineering calculations and design of progressive freeze-drying installations with various ways of a power supply.

  4. Enthalpy of sublimation as measured using a silicon oscillator

    Science.gov (United States)

    Shakeel, Hamza; Pomeroy, J. M.

    In this study, we report the enthalpy of sublimation of common gases (nitrogen, oxygen, argon, carbon dioxide, neon, krypton, xenon, and water vapor) using a large area silicon oscillator with a sub-ng (~0.027 ng/cm2) mass sensitivity. The double paddle oscillator design enables high frequency stability (17 ppb) at cryogenic temperatures and provides a consistent technique for enthalpy measurements. The enthalpies of sublimation are derived from the rate of mass loss during programmed thermal desorption and are detected as a change in the resonance frequency of the self-tracking oscillator. These measured enthalpy values show excellent agreement with the accepted literature values.

  5. Of images and ills. Uses and malaises of sublimation

    Directory of Open Access Journals (Sweden)

    Georges Didi-Huberman

    2017-05-01

    Full Text Available This text is published as postface to the new edition of Invention de l'hystérie. Charcot et l’iconographie photographique de l’hystérie (Macula, Paris, 2012, pp. 364-405 with the title Des images et des maux. It’s also the full version of the lecture organized by the Association Psychanalytique de France (September 24, 2011, entitled L’Usage de la sublimation. Starting from some considerations on his first book, the Author examines limits and potentials of the notion of sublimation in reference with art and artistic creation, and suggests a different way to approach it.

  6. Kinetic and diffusion evaporation of substances on sublimation in vacuum

    International Nuclear Information System (INIS)

    Martinson, I.G.

    2006-01-01

    Diffusion-kinetic model of sublimation of substances in vacuum determining fields of the evaporation according to temperature - kinetic and diffusion is performed. The model is experimentally confirmed in the tests with benzoic acid and naphthalene, by calculation of the rate of Zn, Co, V, W sublimation and the value of coefficient of evaporation α. The model provides an explanation for derivation of low values of evaporation coefficient α, to 10 -10 , for easy to fusible substances, and α=1 for substances with high temperature of fusion [ru

  7. Time-dependent generalized Gibbs ensembles in open quantum systems

    Science.gov (United States)

    Lange, Florian; Lenarčič, Zala; Rosch, Achim

    2018-04-01

    Generalized Gibbs ensembles have been used as powerful tools to describe the steady state of integrable many-particle quantum systems after a sudden change of the Hamiltonian. Here, we demonstrate numerically that they can be used for a much broader class of problems. We consider integrable systems in the presence of weak perturbations which break both integrability and drive the system to a state far from equilibrium. Under these conditions, we show that the steady state and the time evolution on long timescales can be accurately described by a (truncated) generalized Gibbs ensemble with time-dependent Lagrange parameters, determined from simple rate equations. We compare the numerically exact time evolutions of density matrices for small systems with a theory based on block-diagonal density matrices (diagonal ensemble) and a time-dependent generalized Gibbs ensemble containing only a small number of approximately conserved quantities, using the one-dimensional Heisenberg model with perturbations described by Lindblad operators as an example.

  8. A logistic regression estimating function for spatial Gibbs point processes

    DEFF Research Database (Denmark)

    Baddeley, Adrian; Coeurjolly, Jean-François; Rubak, Ege

    We propose a computationally efficient logistic regression estimating function for spatial Gibbs point processes. The sample points for the logistic regression consist of the observed point pattern together with a random pattern of dummy points. The estimating function is closely related to the p......We propose a computationally efficient logistic regression estimating function for spatial Gibbs point processes. The sample points for the logistic regression consist of the observed point pattern together with a random pattern of dummy points. The estimating function is closely related...

  9. Snow sublimation in mountain environments and its sensitivity to forest disturbance and climate warming

    Science.gov (United States)

    Sexstone, Graham A.; Clow, David W.; Fassnacht, Steven R.; Liston, Glen E.; Hiemstra, Christopher A.; Knowles, John F.; Penn, Colin A.

    2018-01-01

    Snow sublimation is an important component of the snow mass balance, but the spatial and temporal variability of this process is not well understood in mountain environments. This study combines a process‐based snow model (SnowModel) with eddy covariance (EC) measurements to investigate (1) the spatio‐temporal variability of simulated snow sublimation with respect to station observations, (2) the contribution of snow sublimation to the ablation of the snowpack, and (3) the sensitivity and response of snow sublimation to bark beetle‐induced forest mortality and climate warming across the north‐central Colorado Rocky Mountains. EC‐based observations of snow sublimation compared well with simulated snow sublimation at stations dominated by surface and canopy sublimation, but blowing snow sublimation in alpine areas was not well captured by the EC instrumentation. Water balance calculations provided an important validation of simulated sublimation at the watershed scale. Simulated snow sublimation across the study area was equivalent to 28% of winter precipitation on average, and the highest relative snow sublimation fluxes occurred during the lowest snow years. Snow sublimation from forested areas accounted for the majority of sublimation fluxes, highlighting the importance of canopy and sub‐canopy surface sublimation in this region. Simulations incorporating the effects of tree mortality due to bark‐beetle disturbance resulted in a 4% reduction in snow sublimation from forested areas. Snow sublimation rates corresponding to climate warming simulations remained unchanged or slightly increased, but total sublimation losses decreased by up to 6% because of a reduction in snow covered area and duration.

  10. The sublime and the grotesque: obscenity in Hilda Hilst

    Directory of Open Access Journals (Sweden)

    Jo A-mi

    2016-08-01

    Full Text Available The present work aims to discuss the dialogical relationship between sublime and grotesque in the work A obscena Senhora D by Hilda Hilst, based on its status of contemporary fiction permeated by reconditioning of the language in its performance in the non-linear time. In this sense, it was used studies of the sublime, as a historical and philosophical and literary concept in the works of Longinus, Edmund Burke, Immanuel Kant, Victor Hugo and François Lyotard; issues relating to discussions on the grotesque and its dialogue with the sublime ways, the works of Mikhail Bakhtin and Michel Maffesoli had great importance - the poetic and obscene relationship of the work discussed in convergent concepts such as obscenity, eroticism, sacred and profane. From these analyzes, it was concluded that in A obscena senhora D the sublime and the grotesque show in a multifaceted character, contradictory, interlocutory, and therefore not exclusionary: solidifying the hybrid linguistic-imagistic flow of the hilstiana literature.

  11. Sublimation-Induced Shape Evolution of Silver Cubes

    KAUST Repository

    Ding, Yong

    2009-12-18

    The heat is on: Surface sublimation and shape transformation of silver cubes, enclosed by {100} surfaces and about 100nm in size, are examined by in situ transmission electron microscopy (see picture). High-index surfaces, such as {110}, of face-centered cubic metals are more stable when the temperature is close to the melting point.

  12. Sublimation as a landform-shaping process on Pluto

    Science.gov (United States)

    Moore, Jeffrey M.; Howard, Alan D.; Umurhan, Orkan M.; White, Oliver L.; Schenk, Paul M.; Beyer, Ross A.; McKinnon, William B.; Spencer, John R.; Grundy, Will M.; Lauer, Tod R.; Nimmo, Francis; Young, Leslie A.; Stern, S. Alan; Weaver, Harold A.; Olkin, Cathy B.; Ennico, Kimberly; New Horizons Science Team

    2017-05-01

    Fields of pits, both large and small, in Tombaugh Regio (Sputnik Planitia, and the Pitted Uplands to the east), and along the scarp of Piri Rupes, are examples of landscapes on Pluto where we conclude that sublimation drives their formation and evolution. Our heuristic modeling closely mimics the form, spacing, and arrangement of a variety of Tombaugh Regio's pits. Pluto's sublimation modified landforms appear to require a significant role for (diffusive) mass wasting as suggested by our modeling. In our models, the temporal evolution of pitted surfaces is such that initially lots of time passes with little happening, then eventually, very rapid development of relief and rapid sublimation. Small pits on Sputnik Planitia are consistent with their formation in N2-dominated materials. As N2-ice readily flows, some other ``stiffer'' volatile ice may play a role in supporting the relief of sublimation degraded landforms that exhibit several hundred meters of relief. A strong candidate is CH4, which is spectroscopically observed to be associated with these features, but the current state of rheological knowledge for CH4 ice at Pluto conditions is insufficient for a firm assessment.

  13. The Religious-Sublime in Music, Literature and Architecture

    DEFF Research Database (Denmark)

    Cifuentes-Aldunate, Claudio

    2018-01-01

    The present article is an attempt to propose the semiotic aspect that produces the ”religious- sublime”. Most of the semiotic characteristics that we use to represent (and produce) the signifiers of the religious-sublime, nevertheless, share their mechanisms with other modalities of ”sublimeness”...

  14. Sublimation-Induced Shape Evolution of Silver Cubes

    KAUST Repository

    Ding, Yong; Fan, Fengru; Tian, Zhongqun; Wang, Zhong Lin

    2009-01-01

    The heat is on: Surface sublimation and shape transformation of silver cubes, enclosed by {100} surfaces and about 100nm in size, are examined by in situ transmission electron microscopy (see picture). High-index surfaces, such as {110}, of face

  15. System for NO reduction using sublimation of cyanuric acid

    Science.gov (United States)

    Perry, R.A.

    1989-01-24

    An arrangement for reducing the NO content of a gas stream comprises contacting the gas stream with HNCO at a temperature effective for heat induced decomposition of HNCO and for resultant lowering of the NO content of the gas stream. Preferably, the HNCO is generated by sublimation of cyanuric acid. 1 fig.

  16. Modular Porous Plate Sublimator /MPPS/ requires only water supply for coolant

    Science.gov (United States)

    Rathbun, R. J.

    1966-01-01

    Modular porous plate sublimators, provided for each location where heat must be dissipated, conserve the battery power of a space vehicle by eliminating the coolant pump. The sublimator requires only a water supply for coolant.

  17. Virial theorem and Gibbs thermodynamic potential for Coulomb systems

    International Nuclear Information System (INIS)

    Bobrov, V. B.; Trigger, S. A.

    2014-01-01

    Using the grand canonical ensemble and the virial theorem, we show that the Gibbs thermodynamic potential of the non-relativistic system of charged particles is uniquely defined by single-particle Green functions of electrons and nuclei. This result is valid beyond the perturbation theory with respect to the interparticle interaction

  18. Virial theorem and Gibbs thermodynamic potential for Coulomb systems

    OpenAIRE

    Bobrov, V. B.; Trigger, S. A.

    2013-01-01

    Using the grand canonical ensemble and the virial theorem, we show that the Gibbs thermodynamic potential of the non-relativistic system of charged particles is uniquely defined by single-particle Green functions of electrons and nuclei. This result is valid beyond the perturbation theory with respect to the interparticle interaction.

  19. Inverse Gaussian model for small area estimation via Gibbs sampling

    African Journals Online (AJOL)

    We present a Bayesian method for estimating small area parameters under an inverse Gaussian model. The method is extended to estimate small area parameters for finite populations. The Gibbs sampler is proposed as a mechanism for implementing the Bayesian paradigm. We illustrate the method by application to ...

  20. Exploring Fourier Series and Gibbs Phenomenon Using Mathematica

    Science.gov (United States)

    Ghosh, Jonaki B.

    2011-01-01

    This article describes a laboratory module on Fourier series and Gibbs phenomenon which was undertaken by 32 Year 12 students. It shows how the use of CAS played the role of an "amplifier" by making higher level mathematical concepts accessible to students of year 12. Using Mathematica students were able to visualise Fourier series of…

  1. Thermodynamic fluctuations within the Gibbs and Einstein approaches

    International Nuclear Information System (INIS)

    Rudoi, Yurii G; Sukhanov, Alexander D

    2000-01-01

    A comparative analysis of the descriptions of fluctuations in statistical mechanics (the Gibbs approach) and in statistical thermodynamics (the Einstein approach) is given. On this basis solutions are obtained for the Gibbs and Einstein problems that arise in pressure fluctuation calculations for a spatially limited equilibrium (or slightly nonequilibrium) macroscopic system. A modern formulation of the Gibbs approach which allows one to calculate equilibrium pressure fluctuations without making any additional assumptions is presented; to this end the generalized Bogolyubov - Zubarev and Hellmann - Feynman theorems are proved for the classical and quantum descriptions of a macrosystem. A statistical version of the Einstein approach is developed which shows a fundamental difference in pressure fluctuation results obtained within the context of two approaches. Both the 'genetic' relation between the Gibbs and Einstein approaches and the conceptual distinction between their physical grounds are demonstrated. To illustrate the results, which are valid for any thermodynamic system, an ideal nondegenerate gas of microparticles is considered, both classically and quantum mechanically. Based on the results obtained, the correspondence between the micro- and macroscopic descriptions is considered and the prospects of statistical thermodynamics are discussed. (reviews of topical problems)

  2. Aerosol volatility and enthalpy of sublimation of carboxylic acids.

    Science.gov (United States)

    Salo, Kent; Jonsson, Asa M; Andersson, Patrik U; Hallquist, Mattias

    2010-04-08

    The enthalpy of sublimation has been determined for nine carboxylic acids, two cyclic (pinonic and pinic acid) and seven straight-chain dicarboxylic acids (C(4) to C(10)). The enthalpy of sublimation was determined from volatility measurements of nano aerosol particles using a volatility tandem differential mobility analyzer (VTDMA) set-up. Compared to the previous use of a VTDMA, this novel method gives enthalpy of sublimation determined over an extended temperature range (DeltaT approximately 40 K). The determined enthalpy of sublimation for the straight-chain dicarboxylic acids ranged from 96 to 161 kJ mol(-1), and the calculated vapor pressures at 298 K are in the range of 10(-6)-10(-3) Pa. These values indicate that dicarboxylic acids can take part in gas-to-particle partitioning at ambient conditions and may contribute to atmospheric nucleation, even though homogeneous nucleation is unlikely. To obtain consistent results, some experimental complications in producing nanosized crystalline aerosol particles were addressed. It was demonstrated that pinonic acid "used as received" needed a further purification step before being suspended as a nanoparticle aerosol. Furthermore, it was noted from distinct differences in thermal properties that aerosols generated from pimelic acid solutions gave two types of particles. These two types were attributed to crystalline and amorphous configurations, and based on measured thermal properties, the enthalpy of vaporization was 127 kJ mol(-1) and that of sublimation was 161 kJ mol(-1). This paper describes a new method that is complementary to other similar methods and provides an extension of existing experimental data on physical properties of atmospherically relevant compounds.

  3. Gibbs energy formation of Sr5Nb4O15

    International Nuclear Information System (INIS)

    Samui, Pradeep; Padhi, Anyuna; Agarwal, Renu; Kulkarni, S.G.

    2012-01-01

    Ternary oxides of strontium and niobium may form as fission product compounds in an operating nuclear reactor with oxide fuels under certain oxygen potential. Evaluations of thermodynamic stability of these ternary oxides are therefore important for assessment of fission product interactions. Furthermore, thermodynamic data of these oxides are also of relevance because of computation of phase diagram and phase stability of pseudo-ternary systems BaO-SrO-Nb 2 O 5 , SrO-Nb 2 O 5 -TaO 5 etc. in which some of the compounds are potential candidate materials for microwave ceramics with high dielectric constant, electro-optic, pyroelectric and piezoelectric devices. The system Sr-Nb-O contains many ternary oxides out of which we have investigated the thermodynamic parameters for the compound Sr 5 Nb 4 O 15 in the present study

  4. The use of computational thermodynamics for the determination of surface tension and Gibbs-Thomson coefficient of multicomponent alloys

    Science.gov (United States)

    Ferreira, D. J. S.; Bezerra, B. N.; Collyer, M. N.; Garcia, A.; Ferreira, I. L.

    2018-04-01

    The simulation of casting processes demands accurate information on the thermophysical properties of the alloy; however, such information is scarce in the literature for multicomponent alloys. Generally, metallic alloys applied in industry have more than three solute components. In the present study, a general solution of Butler's formulation for surface tension is presented for multicomponent alloys and is applied in quaternary Al-Cu-Si-Fe alloys, thus permitting the Gibbs-Thomson coefficient to be determined. Such coefficient is a determining factor to the reliability of predictions furnished by microstructure growth models and by numerical computations of solidification thermal parameters, which will depend on the thermophysical properties assumed in the calculations. The Gibbs-Thomson coefficient for ternary and quaternary alloys is seldom reported in the literature. A numerical model based on Powell's hybrid algorithm and a finite difference Jacobian approximation has been coupled to a Thermo-Calc TCAPI interface to assess the excess Gibbs energy of the liquid phase, permitting liquidus temperature, latent heat, alloy density, surface tension and Gibbs-Thomson coefficient for Al-Cu-Si-Fe hypoeutectic alloys to be calculated, as an example of calculation capabilities for multicomponent alloys of the proposed method. The computed results are compared with thermophysical properties of binary Al-Cu and ternary Al-Cu-Si alloys found in the literature and presented as a function of the Cu solute composition.

  5. Sublimation and thermal decomposition of ammonia borane: Competitive processes controlled by pressure

    Energy Technology Data Exchange (ETDEWEB)

    Kondrat’ev, Yu.V.; Butlak, A.V.; Kazakov, I.V.; Timoshkin, A.Y., E-mail: a.y.timoshkin@spbu.edu

    2015-12-20

    Highlights: • We measured sublimation enthalpy of ammonia borane at 357 K by drop-calorimetry. • We determined activation energy for ammonia borane decomposition by tensimetry. • At 357 K decomposition and sublimation are competitive and depend on the pressure. • We propose new values for the Δ{sub f}H° of solid ammonia borane and polyamidoborane. - Abstract: Thermal behavior of ammonia borane BH{sub 3}NH{sub 3} (AB) has been studied by calorimetry, tensimetry and mass spectrometry methods. It is shown, that depending on vapor pressure in the system two competitive processes are taking place at 357 K. At atmospheric pressure thermal decomposition with hydrogen evolution is the dominant process: BH{sub 3}NH{sub 3(s)} = 1/n (BH{sub 2}NH{sub 2}){sub n(s)} + H{sub 2(g)} (1). At low pressures (circa 4 mTorr) the major process is endothermic sublimation of AB: BH{sub 3}NH{sub 3(s)} = BH{sub 3}NH{sub 3(g)} (2). At intermediate pressures both processes occur simultaneously. Enthalpies for the processes (1) and (2) have been determined by drop-calorimetry method: Δ{sub (1)}H{sub 357}° = −24.8 ± 2.3 kJ mol{sup −1} and Δ{sub sub}H{sub 357}°(BH{sub 3}NH{sub 3}) = 76.3 ± 3.0 kJ mol{sup −1}. Solid products after sublimation and decomposition have been characterized by IR and NMR spectroscopy; gaseous forms were studied by mass spectrometry. Activation energy of 94 ± 11 kJ mol{sup −1} for the process (1) in range 327–351 K was determined by static tensimetry method. Based on the analysis of available thermodynamic characteristics, new values for the standard formation enthalpy of solid AB −133.4 ± 5.2 kJ mol{sup −1} and polyamidoborane −156.7 ± 5.8 kJ mol{sup −1} are recommended.

  6. Local thermodynamics and the generalized Gibbs-Duhem equation in systems with long-range interactions.

    Science.gov (United States)

    Latella, Ivan; Pérez-Madrid, Agustín

    2013-10-01

    The local thermodynamics of a system with long-range interactions in d dimensions is studied using the mean-field approximation. Long-range interactions are introduced through pair interaction potentials that decay as a power law in the interparticle distance. We compute the local entropy, Helmholtz free energy, and grand potential per particle in the microcanonical, canonical, and grand canonical ensembles, respectively. From the local entropy per particle we obtain the local equation of state of the system by using the condition of local thermodynamic equilibrium. This local equation of state has the form of the ideal gas equation of state, but with the density depending on the potential characterizing long-range interactions. By volume integration of the relation between the different thermodynamic potentials at the local level, we find the corresponding equation satisfied by the potentials at the global level. It is shown that the potential energy enters as a thermodynamic variable that modifies the global thermodynamic potentials. As a result, we find a generalized Gibbs-Duhem equation that relates the potential energy to the temperature, pressure, and chemical potential. For the marginal case where the power of the decaying interaction potential is equal to the dimension of the space, the usual Gibbs-Duhem equation is recovered. As examples of the application of this equation, we consider spatially uniform interaction potentials and the self-gravitating gas. We also point out a close relationship with the thermodynamics of small systems.

  7. Sublimator Driven Coldplate Engineering Development Unit Test Results

    Science.gov (United States)

    Sheth, Rubik B.; Stephan, Ryan A.; Leimkuehler, Thomas O.

    2010-01-01

    The Sublimator Driven Coldplate (SDC) is a unique piece of thermal control hardware that has several advantages over a traditional thermal control scheme. The principal advantage is the possible elimination of a pumped fluid loop, potentially increasing reliability and reducing complexity while saving both mass and power. Because the SDC requires a consumable feedwater, it can only be used for short mission durations. Additionally, the SDC is ideal for a vehicle with small transport distances and low heat rejection requirements. An SDC Engineering Development Unit was designed and fabricated. Performance tests were performed in a vacuum chamber to quantify and assess the performance of the SDC. The test data was then used to develop correlated thermal math models. Nonetheless, an Integrated Sublimator Driven Coldplate (ISDC) concept is being developed. The ISDC couples a coolant loop with the previously described SDC hardware. This combination allows the SDC to be used as a traditional coldplate during long mission phases and provides for dissimilar system redundancy

  8. Robust Magnetic Properties of a Sublimable Single-Molecule Magnet.

    Science.gov (United States)

    Kiefl, Evan; Mannini, Matteo; Bernot, Kevin; Yi, Xiaohui; Amato, Alex; Leviant, Tom; Magnani, Agnese; Prokscha, Thomas; Suter, Andreas; Sessoli, Roberta; Salman, Zaher

    2016-06-28

    The organization of single-molecule magnets (SMMs) on surfaces via thermal sublimation is a prerequisite for the development of future devices for spintronics exploiting the richness of properties offered by these magnetic molecules. However, a change in the SMM properties due to the interaction with specific surfaces is usually observed. Here we present a rare example of an SMM system that can be thermally sublimated on gold surfaces while maintaining its intact chemical structure and magnetic properties. Muon spin relaxation and ac susceptibility measurements are used to demonstrate that, unlike other SMMs, the magnetic properties of this system in thin films are very similar to those in the bulk, throughout the full volume of the film, including regions near the metal and vacuum interfaces. These results exhibit the robustness of chemical and magnetic properties of this complex and provide important clues for the development of nanostructures based on SMMs.

  9. Trust: the sublime duty in health care leadership.

    Science.gov (United States)

    Piper, Llewellyn E

    2010-01-01

    Trust is the essence of human social existence. From the moment of birth, trust is the basic component in any human relationship and interaction. Trust is the Holy Grail for human confidence in others. From human survival to organizational survival, trust is the primordial bond. No organization is more dependent on trust than health care. This article views trust as the most basic fundamental quality for leadership. Trust is a sublime duty of a leader and the leadership of an organization. Leadership sets the culture of trust. Trust is the one quality that is essential for guiding an organization toward serving others. This article addresses trust from many perspectives. Trust is viewed from our subordinates, our peers, our superiors, and the public we serve. This article postulates how trust in an organization is the sublime duty of leadership that unites all human understanding and without it destroys all human relationships.

  10. TRIGGERING SUBLIMATION-DRIVEN ACTIVITY OF MAIN BELT COMETS

    Energy Technology Data Exchange (ETDEWEB)

    Haghighipour, N. [Institute for Astronomy, University of Hawaii-Manoa, Honolulu, HI 96825 (United States); Maindl, T. I.; Dvorak, R. [Department of Astrophysics, University of Vienna, Türkenschanzstrasse 17, A-1180 Vienna (Austria); Schäfer, C. [Institut für Astronomie und Astrophysik, Eberhard Karls Universität Tübingen, Auf der Morgenstelle 10, D-72076 Tübingen (Germany); Speith, R., E-mail: nader@ifa.hawaii.edu [Physikalisches Institut, Eberhard Karls Universität Tübingen, Auf der Morgenstelle 14, D-72076 Tübingen (Germany)

    2016-10-10

    It has been suggested that the comet-like activity of main belt comets (MBCs) is due to the sublimation of sub-surface water–ice that has been exposed as a result of their surfaces being impacted by meter-sized bodies. We have examined the viability of this scenario by simulating impacts between meter-sized and kilometer-sized objects using a smooth particle hydrodynamics approach. Simulations have been carried out for different values of the impact velocity and impact angle, as well as different target material and water-mass fractions. Results indicate that for the range of impact velocities corresponding to those in the asteroid belt, the depth of an impact crater is slightly larger than 10 m, suggesting that if the activation of MBCs is due to the sublimation of sub-surface water–ice, this ice has to exist no deeper than a few meters from the surface. Results also show that ice exposure occurs in the bottom and on the interior surface of impact craters, as well as on the surface of the target where some of the ejected icy inclusions are re-accreted. While our results demonstrate that the impact scenario is indeed a viable mechanism to expose ice and trigger the activity of MBCs, they also indicate that the activity of the current MBCs is likely due to ice sublimation from multiple impact sites and/or the water contents of these objects (and other asteroids in the outer asteroid belt) is larger than the 5% that is traditionally considered in models of terrestrial planet formation, providing more ice for sublimation. We present the details of our simulations and discuss their results and implications.

  11. Optimization of fast dissolving etoricoxib tablets prepared by sublimation technique

    OpenAIRE

    Patel D; Patel M

    2008-01-01

    The purpose of this investigation was to develop fast dissolving tablets of etoricoxib. Granules containing etoricoxib, menthol, crospovidone, aspartame and mannitol were prepared by wet granulation technique. Menthol was sublimed from the granules by exposing the granules to vacuum. The porous granules were then compressed in to tablets. Alternatively, tablets were first prepared and later exposed to vacuum. The tablets were evaluated for percentage friability and disintegration time. A 3 2 ...

  12. Inferring the Gibbs state of a small quantum system

    International Nuclear Information System (INIS)

    Rau, Jochen

    2011-01-01

    Gibbs states are familiar from statistical mechanics, yet their use is not limited to that domain. For instance, they also feature in the maximum entropy reconstruction of quantum states from incomplete measurement data. Outside the macroscopic realm, however, estimating a Gibbs state is a nontrivial inference task, due to two complicating factors: the proper set of relevant observables might not be evident a priori; and whenever data are gathered from a small sample only, the best estimate for the Lagrange parameters is invariably affected by the experimenter's prior bias. I show how the two issues can be tackled with the help of Bayesian model selection and Bayesian interpolation, respectively, and illustrate the use of these Bayesian techniques with a number of simple examples.

  13. El Silencio de la Sirena: lo Sublime en Alejandra Pizarnik

    Directory of Open Access Journals (Sweden)

    Julieta Lerman

    2012-12-01

    Full Text Available Algunas poéticas de las décadas del cincuenta y del sesenta parecerían constituirse en torno a un vacío, un silencio que a veces inspira la palabra poética y otras veces la aborta. Esa ambigüedad, característica de la poética de Alejandra Pizarnik, podemos entenderla como una “reedición” de la estética de lo sublime. Lo sublime es un concepto estético-filosófico que plantearon filósofos como Inmanuel Kant y Edmund Burke para pensar el arte romántico y, en el siglo XX, otros autores como Jean-François Lyotard, lo retomaron para analizar el arte de vanguardia. Así, lo sublime nos permite repensar la poética de Pizarnik en sus coincidencias y oposiciones a otras de la tradición moderna (como la de Charles Baudelaire o de las vanguardias latinoamericanas (como Oliverio Girondo y Vicente Huidobro.

  14. Ad infinitum: implicaciones de lo sublime en la contemporaneidad

    Directory of Open Access Journals (Sweden)

    Miguel Ángel Gaete Cáceres

    2014-12-01

    Full Text Available El presente texto es un estudio que ofrece una revisión crítica al concepto de lo sublime basándose en la teorización clásica de esta idea, es decir, la adjudicada a Longino, Edmund Burke e Immanuel Kant. A partir de aquí, se intentará descubrir la presencia de lo sublime como un factor relevante en la configuración cultural del mundo contemporáneo, pasando por su presencia innegable en el arte de las vanguardias o en la concepción de la Naturaleza y el entorno. Finalmente, el objetivo central de este escrito es demostrar como lo sublime ofrece también una alternativa para comprender el problema de "lo infinito" y "lo ilimitado" en el marco de las tecnologías, la eclosión de las grandes ciudades y su filtración en el sustrato retórico del capitalismo, ofreciendo así una vía diferente en el estudio de este tema clásico de la estética.

  15. El Silencio de la Sirena: lo Sublime en Alejandra Pizarnik

    Directory of Open Access Journals (Sweden)

    Julieta Lerman

    2012-03-01

    Full Text Available http://dx.doi.org/10.5007/1984-784X.2012v12n17p85 Algunas poéticas de las décadas del cincuenta y del sesenta parecerían constituirse en torno a un vacío, un silencio que a veces inspira la palabra poética y otras veces la aborta. Esa ambigüedad, característica de la poética de Alejandra Pizarnik, podemos entenderla como una “reedición” de la estética de lo sublime. Lo sublime es un concepto estético-filosófico que plantearon filósofos como Inmanuel Kant y Edmund Burke para pensar el arte romántico y, en el siglo XX, otros autores como Jean-François Lyotard, lo retomaron para analizar el arte de vanguardia. Así, lo sublime nos permite repensar la poética de Pizarnik en sus coincidencias y oposiciones a otras de la tradición moderna (como la de Charles Baudelaire o de las vanguardias latinoamericanas (como Oliverio Girondo y Vicente Huidobro.

  16. On the Tsallis Entropy for Gibbs Random Fields

    Czech Academy of Sciences Publication Activity Database

    Janžura, Martin

    2014-01-01

    Roč. 21, č. 33 (2014), s. 59-69 ISSN 1212-074X R&D Projects: GA ČR(CZ) GBP402/12/G097 Institutional research plan: CEZ:AV0Z1075907 Keywords : Tsallis entropy * Gibbs random fields * phase transitions * Tsallis entropy rate Subject RIV: BB - Applied Statistics, Operational Research http://library.utia.cas.cz/separaty/2014/SI/janzura-0441885.pdf

  17. Extensitivity of entropy and modern form of Gibbs paradox

    International Nuclear Information System (INIS)

    Home, D.; Sengupta, S.

    1981-01-01

    The extensivity property of entropy is clarified in the light of a critical examination of the entropy formula based on quantum statistics and the relevant thermodynamic requirement. The modern form of the Gibbs paradox, related to the discontinuous jump in entropy due to identity or non-identity of particles, is critically investigated. Qualitative framework of a new resolution of this paradox, which analyses the general effect of distinction mark on the Hamiltonian of a system of identical particles, is outlined. (author)

  18. GibbsCluster: unsupervised clustering and alignment of peptide sequences

    DEFF Research Database (Denmark)

    Andreatta, Massimo; Alvarez, Bruno; Nielsen, Morten

    2017-01-01

    motif characterizing each cluster. Several parameters are available to customize cluster analysis, including adjustable penalties for small clusters and overlapping groups and a trash cluster to remove outliers. As an example application, we used the server to deconvolute multiple specificities in large......-scale peptidome data generated by mass spectrometry. The server is available at http://www.cbs.dtu.dk/services/GibbsCluster-2.0....

  19. Variación de la energía libre de Gibbs de la caolinita en función de la cristalinidad y tamaño de partícula

    OpenAIRE

    La Iglesia, A.

    1989-01-01

    The effect of grinding on crystallinity, particle size and solubility of two samples of kaolinite was studied. The standard Gibbs free energies of formation of different ground samples were calculated from solubility measurements, and show a direct relationship between Gibbs free energy and particle size-crystallinity variation. Values of -3752.2 and -3776.4 KJ/mol. were determinated for ΔGºl (am) and ΔGºl (crys) of kaolinite, respectively. A new th...

  20. GPU-accelerated Gibbs ensemble Monte Carlo simulations of Lennard-Jonesium

    Science.gov (United States)

    Mick, Jason; Hailat, Eyad; Russo, Vincent; Rushaidat, Kamel; Schwiebert, Loren; Potoff, Jeffrey

    2013-12-01

    This work describes an implementation of canonical and Gibbs ensemble Monte Carlo simulations on graphics processing units (GPUs). The pair-wise energy calculations, which consume the majority of the computational effort, are parallelized using the energetic decomposition algorithm. While energetic decomposition is relatively inefficient for traditional CPU-bound codes, the algorithm is ideally suited to the architecture of the GPU. The performance of the CPU and GPU codes are assessed for a variety of CPU and GPU combinations for systems containing between 512 and 131,072 particles. For a system of 131,072 particles, the GPU-enabled canonical and Gibbs ensemble codes were 10.3 and 29.1 times faster (GTX 480 GPU vs. i5-2500K CPU), respectively, than an optimized serial CPU-bound code. Due to overhead from memory transfers from system RAM to the GPU, the CPU code was slightly faster than the GPU code for simulations containing less than 600 particles. The critical temperature Tc∗=1.312(2) and density ρc∗=0.316(3) were determined for the tail corrected Lennard-Jones potential from simulations of 10,000 particle systems, and found to be in exact agreement with prior mixed field finite-size scaling calculations [J.J. Potoff, A.Z. Panagiotopoulos, J. Chem. Phys. 109 (1998) 10914].

  1. The application of computational thermodynamics and a numerical model for the determination of surface tension and Gibbs-Thomson coefficient of aluminum based alloys

    International Nuclear Information System (INIS)

    Jacome, Paulo A.D.; Landim, Mariana C.; Garcia, Amauri; Furtado, Alexandre F.; Ferreira, Ivaldo L.

    2011-01-01

    Highlights: → Surface tension and the Gibbs-Thomson coefficient are computed for Al-based alloys. → Butler's scheme and ThermoCalc are used to compute the thermophysical properties. → Predictive cell/dendrite growth models depend on accurate thermophysical properties. → Mechanical properties can be related to the microstructural cell/dendrite spacing. - Abstract: In this paper, a solution for Butler's formulation is presented permitting the surface tension and the Gibbs-Thomson coefficient of Al-based binary alloys to be determined. The importance of Gibbs-Thomson coefficient for binary alloys is related to the reliability of predictions furnished by predictive cellular and dendritic growth models and of numerical computations of solidification thermal variables, which will be strongly dependent on the thermophysical properties assumed for the calculations. A numerical model based on Powell hybrid algorithm and a finite difference Jacobian approximation was coupled to a specific interface of a computational thermodynamics software in order to assess the excess Gibbs energy of the liquid phase, permitting the surface tension and Gibbs-Thomson coefficient for Al-Fe, Al-Ni, Al-Cu and Al-Si hypoeutectic alloys to be calculated. The computed results are presented as a function of the alloy composition.

  2. The application of computational thermodynamics and a numerical model for the determination of surface tension and Gibbs-Thomson coefficient of aluminum based alloys

    Energy Technology Data Exchange (ETDEWEB)

    Jacome, Paulo A.D.; Landim, Mariana C. [Department of Mechanical Engineering, Fluminense Federal University, Av. dos Trabalhadores, 420-27255-125 Volta Redonda, RJ (Brazil); Garcia, Amauri, E-mail: amaurig@fem.unicamp.br [Department of Materials Engineering, University of Campinas, UNICAMP, PO Box 6122, 13083-970 Campinas, SP (Brazil); Furtado, Alexandre F.; Ferreira, Ivaldo L. [Department of Mechanical Engineering, Fluminense Federal University, Av. dos Trabalhadores, 420-27255-125 Volta Redonda, RJ (Brazil)

    2011-08-20

    Highlights: {yields} Surface tension and the Gibbs-Thomson coefficient are computed for Al-based alloys. {yields} Butler's scheme and ThermoCalc are used to compute the thermophysical properties. {yields} Predictive cell/dendrite growth models depend on accurate thermophysical properties. {yields} Mechanical properties can be related to the microstructural cell/dendrite spacing. - Abstract: In this paper, a solution for Butler's formulation is presented permitting the surface tension and the Gibbs-Thomson coefficient of Al-based binary alloys to be determined. The importance of Gibbs-Thomson coefficient for binary alloys is related to the reliability of predictions furnished by predictive cellular and dendritic growth models and of numerical computations of solidification thermal variables, which will be strongly dependent on the thermophysical properties assumed for the calculations. A numerical model based on Powell hybrid algorithm and a finite difference Jacobian approximation was coupled to a specific interface of a computational thermodynamics software in order to assess the excess Gibbs energy of the liquid phase, permitting the surface tension and Gibbs-Thomson coefficient for Al-Fe, Al-Ni, Al-Cu and Al-Si hypoeutectic alloys to be calculated. The computed results are presented as a function of the alloy composition.

  3. The sublimation kinetics of GeSe single crystals

    Science.gov (United States)

    Irene, E. A.; Wiedemeier, H.

    1975-01-01

    The sublimation kinetics of (001) oriented GeSe single crystal platelets was studied by high-temperature mass spectroscopy, quantitative vacuum microbalance techniques, and hot stage optical microscopy. For a mean experimental temperature of 563 K, the activation enthalpy and entropy are found to equal 32.3 kcal/mole and 19.1 eu, respectively. The vaporization coefficient is less than unity for the range of test temperatures, and decreases with increasing temperature. The combined experimental data are correlated by means of a multistep surface adsorption mechanism.

  4. Figure del desiderio: l'amore fra distruzione e sublime

    Directory of Open Access Journals (Sweden)

    Mabel Franzone

    2005-03-01

    Full Text Available Attraverso due racconti di Cortázar, l'analisi di due figure del desiderio ci permette esplorare due estremi seguendo una verticalità. La distruzione, doppio tenebroso della nostra anima, ci rivela un erotismo legato alla morte e al desiderio morboso di possedere l'Altro; il suo contraltare è un'ascesa vertiginosa accompagnata da un godimento estetico, dall'amore sublime prossimo all'esperienza mistica che si concluderà con una discesa progressiva e nel rispetto di questo Altro. La creazione letteraria si presenta come uno sfogo alle nostre angosce, che sono anche una sorta d'espressione dell'erotismo.

  5. Quantitative Boltzmann-Gibbs Principles via Orthogonal Polynomial Duality

    Science.gov (United States)

    Ayala, Mario; Carinci, Gioia; Redig, Frank

    2018-06-01

    We study fluctuation fields of orthogonal polynomials in the context of particle systems with duality. We thereby obtain a systematic orthogonal decomposition of the fluctuation fields of local functions, where the order of every term can be quantified. This implies a quantitative generalization of the Boltzmann-Gibbs principle. In the context of independent random walkers, we complete this program, including also fluctuation fields in non-stationary context (local equilibrium). For other interacting particle systems with duality such as the symmetric exclusion process, similar results can be obtained, under precise conditions on the n particle dynamics.

  6. Near-Optimal Detection in MIMO Systems using Gibbs Sampling

    DEFF Research Database (Denmark)

    Hansen, Morten; Hassibi, Babak; Dimakis, Georgios Alexandros

    2009-01-01

    In this paper we study a Markov Chain Monte Carlo (MCMC) Gibbs sampler for solving the integer least-squares problem. In digital communication the problem is equivalent to preforming Maximum Likelihood (ML) detection in Multiple-Input Multiple-Output (MIMO) systems. While the use of MCMC methods...... sampler provides a computationally efficient way of achieving approximative ML detection in MIMO systems having a huge number of transmit and receive dimensions. In fact, they further suggest that the Markov chain is rapidly mixing. Thus, it has been observed that even in cases were ML detection using, e...

  7. Past, present, and future of sublimation transfer imaging

    Science.gov (United States)

    Akada, Masanori

    1990-07-01

    SONY's announcement of tlavica system shaked the world in 1981. In the new nonphotographic imaging system, image is acquired with CCD to be converted into electric image-signal, stored in magnetic recording media,displayed on a CR1 and printed on a special sheet. To get a hard copy, Sublimation Transfer technology was developed. That announcement brought about world-wide R&D of competitive color imaging systems: Ink-jet, Wax transfer,. Sublimation Transfer(ST) and Electrophotography. In spite of much effort,most of those were insufficient for getting a good hard copy. Developing sufficient ST recording media, Dai Nippon Printing started ST recording media business in 1986. It was the first manufacturing scale production and sale of ST recording media in the world. Nowadays ST technology is known for its advantages: high image quality, consistency from copy to copy, smooth tone-reproduction from high-light to maximum density, and easiness to use. In the following paper progress of ST recording media and the present situation and future markets of the media will be presented.

  8. Just Another Gibbs Additive Modeler: Interfacing JAGS and mgcv

    Directory of Open Access Journals (Sweden)

    Simon N. Wood

    2016-12-01

    Full Text Available The BUGS language offers a very flexible way of specifying complex statistical models for the purposes of Gibbs sampling, while its JAGS variant offers very convenient R integration via the rjags package. However, including smoothers in JAGS models can involve some quite tedious coding, especially for multivariate or adaptive smoothers. Further, if an additive smooth structure is required then some care is needed, in order to centre smooths appropriately, and to find appropriate starting values. R package mgcv implements a wide range of smoothers, all in a manner appropriate for inclusion in JAGS code, and automates centring and other smooth setup tasks. The purpose of this note is to describe an interface between mgcv and JAGS, based around an R function, jagam, which takes a generalized additive model (GAM as specified in mgcv and automatically generates the JAGS model code and data required for inference about the model via Gibbs sampling. Although the auto-generated JAGS code can be run as is, the expectation is that the user would wish to modify it in order to add complex stochastic model components readily specified in JAGS. A simple interface is also provided for visualisation and further inference about the estimated smooth components using standard mgcv functionality. The methods described here will be un-necessarily inefficient if all that is required is fully Bayesian inference about a standard GAM, rather than the full flexibility of JAGS. In that case the BayesX package would be more efficient.

  9. Reflections on Gibbs: From Statistical Physics to the Amistad V3.0

    Science.gov (United States)

    Kadanoff, Leo P.

    2014-07-01

    This note is based upon a talk given at an APS meeting in celebration of the achievements of J. Willard Gibbs. J. Willard Gibbs, the younger, was the first American physical sciences theorist. He was one of the inventors of statistical physics. He introduced and developed the concepts of phase space, phase transitions, and thermodynamic surfaces in a remarkably correct and elegant manner. These three concepts form the basis of different areas of physics. The connection among these areas has been a subject of deep reflection from Gibbs' time to our own. This talk therefore celebrated Gibbs by describing modern ideas about how different parts of physics fit together. I finished with a more personal note. Our own J. Willard Gibbs had all his many achievements concentrated in science. His father, also J. Willard Gibbs, also a Professor at Yale, had one great non-academic achievement that remains unmatched in our day. I describe it.

  10. Meteorological conditions associated to high sublimation amounts in semiarid high-elevation Andes decrease the performance of empirical melt models

    Science.gov (United States)

    Ayala, Alvaro; Pellicciotti, Francesca; MacDonell, Shelley; McPhee, James; Burlando, Paolo

    2015-04-01

    Empirical melt (EM) models are often preferred to surface energy balance (SEB) models to calculate melt amounts of snow and ice in hydrological modelling of high-elevation catchments. The most common reasons to support this decision are that, in comparison to SEB models, EM models require lower levels of meteorological data, complexity and computational costs. However, EM models assume that melt can be characterized by means of a few index variables only, and their results strongly depend on the transferability in space and time of the calibrated empirical parameters. In addition, they are intrinsically limited in accounting for specific process components, the complexity of which cannot be easily reconciled with the empirical nature of the model. As an example of an EM model, in this study we use the Enhanced Temperature Index (ETI) model, which calculates melt amounts using air temperature and the shortwave radiation balance as index variables. We evaluate the performance of the ETI model on dry high-elevation sites where sublimation amounts - that are not explicitly accounted for the EM model - represent a relevant percentage of total ablation (1.1 to 8.7%). We analyse a data set of four Automatic Weather Stations (AWS), which were collected during the ablation season 2013-14, at elevations between 3466 and 4775 m asl, on the glaciers El Tapado, San Francisco, Bello and El Yeso, which are located in the semiarid Andes of central Chile. We complement our analysis using data from past studies in Juncal Norte Glacier (Chile) and Haut Glacier d'Arolla (Switzerland), during the ablation seasons 2008-09 and 2006, respectively. We use the results of a SEB model, applied to each study site, along the entire season, to calibrate the ETI model. The ETI model was not designed to calculate sublimation amounts, however, results show that their ability is low also to simulate melt amounts at sites where sublimation represents larger percentages of total ablation. In fact, we

  11. Characteristics of Vacuum Freeze Drying with Utilization of Internal Cooling and Condenser Waste Heat for Sublimation

    Directory of Open Access Journals (Sweden)

    Muhammad Alhamid

    2013-09-01

    Full Text Available Vacuum freeze drying is an excellent drying method, but it is very energy-intensive because a relatively long drying time is required. This research investigates the utilization of condenser waste heat for sublimation as a way of accelerating the drying rate. In addition, it also investigates the effect of internal cooling combined with vacuum cooling in the pressure reduction process. Jelly fish tentacles were used as the specimen, with different configurations for condenser heat waste and internal cooling valve opening. The results show that heating with condenser heat waste can accelerate the drying rate up to 0.0035 kg/m2.s. In addition, pre-freezing by internal cooling prevents evaporation until the mass of the specimen is 0.47 g and promotes transition of the specimen into the solid phase.

  12. Matrix isolation sublimation: An apparatus for producing cryogenic beams of atoms and molecules

    Energy Technology Data Exchange (ETDEWEB)

    Sacramento, R. L.; Alves, B. X.; Silva, B. A.; Wolff, W.; Cesar, C. L. [Instituto de Física, Universidade Federal do Rio de Janeiro, Caixa Postal 68528, 21941-972 Rio de Janeiro, RJ (Brazil); Oliveira, A. N. [Instituto de Física, Universidade Federal do Rio de Janeiro, Caixa Postal 68528, 21941-972 Rio de Janeiro, RJ (Brazil); INMETRO, Av. Nossa Senhora das Graças, 50 25250-020 Duque de Caxias, RJ (Brazil); Li, M. S. [Instituto de Física de São Carlos, Universidade de São Paulo, Ave. Trabalhador São Carlense, 400, 13565-590 São Carlos, SP (Brazil)

    2015-07-15

    We describe the apparatus to generate cryogenic beams of atoms and molecules based on matrix isolation sublimation. Isolation matrices of Ne and H{sub 2} are hosts for atomic and molecular species which are sublimated into vacuum at cryogenic temperatures. The resulting cryogenic beams are used for high-resolution laser spectroscopy. The technique also aims at loading atomic and molecular traps.

  13. Vapour pressures of 1-methyl derivatives of benzimidazole, pyrazole and indole. The energy of the intermolecular hydrogen bond N-H⋯N

    International Nuclear Information System (INIS)

    Almeida, Ana R.R.P.; Monte, Manuel J.S.

    2014-01-01

    Highlights: • Vapour pressures of 1-methyl derivatives of benzimidazole, pyrazole and indole. • Enthalpies, entropies and Gibbs free energies of sublimation/vaporisation were derived. • Temperatures and enthalpies of fusion were determined. • Energy of the intermolecular hydrogen bond N-H⋯N was estimated. - Abstract: The vapour pressures of the liquid phase of 1-methylpyrazole, 1-methylbenzimidazole and 1-methylindole were measured over the temperature ranges (253.9 to 293.3) K, (303.2 to 372.5) K, and (268.6 to 341.9) K, respectively, using a static method. The vapour pressures of the crystalline phase of the two latter compounds were also measured at temperatures between (301.2 to 328.9) K and (267.6 to 275.5) K, respectively. The results obtained enabled the determination of the standard molar enthalpies and entropies of sublimation and of vaporisation at the mean temperatures of the measurements and at T = 298.15 K. The temperatures and molar enthalpies of fusion were determined using differential scanning calorimetry. The enthalpies of the intermolecular hydrogen bonds N-H⋯N in the crystalline phase of benzimidazole and pyrazole were determined and compared with the result previously determined for the energy of the intermolecular hydrogen bond in crystalline imidazole

  14. Uranium hexaflouride freezer/sublimer process simulator/trainer

    International Nuclear Information System (INIS)

    Carnal, C.L.; Belcher, J.D.; Tapp, P.A.; Ruppel, F.R.; Wells, J.C.

    1991-01-01

    This paper describes a software and hardware simulation of a freezer/sublimer unit used in gaseous diffusion processing of uranium hexafluoride (UF 6 ). The objective of the project was to build a plant simulator that reads control signals and produces plant signals to mimic the behavior of an actual plant. The model is based on physical principles and process data. Advanced Continuous Simulation Language (ACSL) was used to develop the model. Once the simulation was validated with actual plant process data, the ACSL model was translated into Advanced Communication and Control Oriented Language (ACCOL). A Bristol Babcock Distributed Process Controller (DPC) Model 3330 was the hardware platform used to host the ACCOL model and process the real world signals. The DPC will be used as a surrogate plant to debug control system hardware/software and to train operators to use the new distributed control system without disturbing the process. 2 refs., 4 figs

  15. Methods of conveying fluids and methods of sublimating solid particles

    Science.gov (United States)

    Turner, Terry D; Wilding, Bruce M

    2013-10-01

    A heat exchanger and associated methods for sublimating solid particles therein, for conveying fluids therethrough, or both. The heat exchanger includes a chamber and a porous member having a porous wall having pores in communication with the chamber and with an interior of the porous member. A first fluid is conveyed into the porous member while a second fluid is conveyed into the porous member through the porous wall. The second fluid may form a positive flow boundary layer along the porous wall to reduce or eliminate substantial contact between the first fluid and the interior of the porous wall. The combined first and second fluids are conveyed out of the porous member. Additionally, the first fluid and the second fluid may each be conveyed into the porous member at different temperatures and may exit the porous member at substantially the same temperature.

  16. Work and entropy production in generalised Gibbs ensembles

    International Nuclear Information System (INIS)

    Perarnau-Llobet, Martí; Riera, Arnau; Gallego, Rodrigo; Wilming, Henrik; Eisert, Jens

    2016-01-01

    Recent years have seen an enormously revived interest in the study of thermodynamic notions in the quantum regime. This applies both to the study of notions of work extraction in thermal machines in the quantum regime, as well as to questions of equilibration and thermalisation of interacting quantum many-body systems as such. In this work we bring together these two lines of research by studying work extraction in a closed system that undergoes a sequence of quenches and equilibration steps concomitant with free evolutions. In this way, we incorporate an important insight from the study of the dynamics of quantum many body systems: the evolution of closed systems is expected to be well described, for relevant observables and most times, by a suitable equilibrium state. We will consider three kinds of equilibration, namely to (i) the time averaged state, (ii) the Gibbs ensemble and (iii) the generalised Gibbs ensemble, reflecting further constants of motion in integrable models. For each effective description, we investigate notions of entropy production, the validity of the minimal work principle and properties of optimal work extraction protocols. While we keep the discussion general, much room is dedicated to the discussion of paradigmatic non-interacting fermionic quantum many-body systems, for which we identify significant differences with respect to the role of the minimal work principle. Our work not only has implications for experiments with cold atoms, but also can be viewed as suggesting a mindset for quantum thermodynamics where the role of the external heat baths is instead played by the system itself, with its internal degrees of freedom bringing coarse-grained observables to equilibrium. (paper)

  17. Calculational criticality analyses of 10- and 20-MW UF6 freezer/sublimer vessels

    International Nuclear Information System (INIS)

    Jordan, W.C.

    1993-02-01

    Calculational criticality analyses have been performed for 10- and 20-MW UF 6 freezer/sublimer vessels. The freezer/sublimers have been analyzed over a range of conditions that encompass normal operation and abnormal conditions. The effects of HF moderation of the UF 6 in each vessel have been considered for uranium enriched between 2 and 5 wt % 235 U. The results indicate that the nuclearly safe enrichments originally established for the operation of a 10-MW freezer/sublimer, based on a hydrogen-to-uranium moderation ratio of 0.33, are acceptable. If strict moderation control can be demonstrated for hydrogen-to-uranium moderation ratios that are less than 0.33, then the enrichment limits for the 10-MW freezer/sublimer may be increased slightly. The calculations performed also allow safe enrichment limits to be established for a 20-NM freezer/sublimer under moderation control

  18. Fe embedded in ice: The impacts of sublimation and energetic particle bombardment

    Science.gov (United States)

    Frankland, Victoria L.; Plane, John M. C.

    2015-05-01

    Icy particles containing a variety of Fe compounds are present in the upper atmospheres of planets such as the Earth and Saturn. In order to explore the role of ice sublimation and energetic ion bombardment in releasing Fe species into the gas phase, Fe-dosed ice films were prepared under UHV conditions in the laboratory. Temperature-programmed desorption studies of Fe/H2O films revealed that no Fe atoms or Fe-containing species co-desorbed along with the H2O molecules. This implies that when noctilucent ice cloud particles sublimate in the terrestrial mesosphere, the metallic species embedded in them will coalesce to form residual particles. Sputtering of the Fe-ice films by energetic Ar+ ions was shown to be an efficient mechanism for releasing Fe into the gas phase, with a yield of 0.08 (Ar+ energy=600 eV). Extrapolating with a semi-empirical sputtering model to the conditions of a proton aurora indicates that sputtering by energetic protons (>100 keV) should also be efficient. However, the proton flux in even an intense aurora will be too low for the resulting injection of Fe species into the gas phase to compete with that from meteoric ablation. In contrast, sputtering of the icy particles in the main rings of Saturn by energetic O+ ions may be the source of recently observed Fe+ in the Saturnian magnetosphere. Electron sputtering (9.5 keV) produced no detectable Fe atoms or Fe-containing species. Finally, it was observed that Fe(OH)2 was produced when Fe was dosed onto an ice film at 140 K (but not at 95 K). Electronic structure theory shows that the reaction which forms this hydroxide from adsorbed Fe has a large barrier of about 0.7 eV, from which we conclude that the reaction requires both translationally hot Fe atoms and mobile H2O molecules on the ice surface.

  19. Continuous spin mean-field models : Limiting kernels and Gibbs properties of local transforms

    NARCIS (Netherlands)

    Kulske, Christof; Opoku, Alex A.

    2008-01-01

    We extend the notion of Gibbsianness for mean-field systems to the setup of general (possibly continuous) local state spaces. We investigate the Gibbs properties of systems arising from an initial mean-field Gibbs measure by application of given local transition kernels. This generalizes previous

  20. Large scale inference in the Infinite Relational Model: Gibbs sampling is not enough

    DEFF Research Database (Denmark)

    Albers, Kristoffer Jon; Moth, Andreas Leon Aagard; Mørup, Morten

    2013-01-01

    . We find that Gibbs sampling can be computationally scaled to handle millions of nodes and billions of links. Investigating the behavior of the Gibbs sampler for different sizes of networks we find that the mixing ability decreases drastically with the network size, clearly indicating a need...

  1. One of Gibbs's ideas that has gone unnoticed (comment on chapter IX of his classic book)

    International Nuclear Information System (INIS)

    Sukhanov, Alexander D; Rudoi, Yurii G

    2006-01-01

    We show that contrary to the commonly accepted view, Chapter IX of Gibbs's book [1] contains the prolegomena to a macroscopic statistical theory that is qualitatively different from his own microscopic statistical mechanics. The formulas obtained by Gibbs were the first results in the history of physics related to the theory of fluctuations in any macroparameters, including temperature. (from the history of physics)

  2. Dynamical predictive power of the generalized Gibbs ensemble revealed in a second quench.

    Science.gov (United States)

    Zhang, J M; Cui, F C; Hu, Jiangping

    2012-04-01

    We show that a quenched and relaxed completely integrable system is hardly distinguishable from the corresponding generalized Gibbs ensemble in a dynamical sense. To be specific, the response of the quenched and relaxed system to a second quench can be accurately reproduced by using the generalized Gibbs ensemble as a substitute. Remarkably, as demonstrated with the transverse Ising model and the hard-core bosons in one dimension, not only the steady values but even the transient, relaxation dynamics of the physical variables can be accurately reproduced by using the generalized Gibbs ensemble as a pseudoinitial state. This result is an important complement to the previously established result that a quenched and relaxed system is hardly distinguishable from the generalized Gibbs ensemble in a static sense. The relevance of the generalized Gibbs ensemble in the nonequilibrium dynamics of completely integrable systems is then greatly strengthened.

  3. On the use of semiempirical models of (solid + supercritical fluid) systems to determine solid sublimation properties

    International Nuclear Information System (INIS)

    Tabernero, Antonio; Martin del Valle, Eva M.; Galan, Miguel A.

    2011-01-01

    Research highlights: → We propose a method to determine sublimation properties of solids. → Low deviations were produced calculating sublimation enthalpies and pressures. → It is a required step to determine the vaporization enthalpy of the solid. → It is possible to determine solid properties using semiempirical models solid-SCF. - Abstract: Experimental solubility data of solid-supercritical fluids have significantly increased in the last few years, and semiempirical models are emerging as one of the best choices to fit this type of data. This work establishes a methodology to calculate sublimation pressures using this type of equations. It requires the use of Bartle's equation to model equilibria data solid-supercritical fluids with the aim of determining the vaporization enthalpy of the compound. Using this method, low deviations were obtained by calculating sublimation pressures and sublimation enthalpies. The values of the sublimation pressures were subsequently used to successfully model different multiphasic equilibria, as solid-supercritical fluids and solid-solvent-supercritical fluids with the Peng-Robinson equation of state (without considering the sublimation pressure as an adjustable parameter). On the other hand, the sublimation pressures were also used to calculate solid sublimation properties and acetaminophen solvation properties in some solvents. Also, solubility data solid-supercritical fluids from 62 pharmaceuticals were fitted with different semiempirical equations (Chrastil, Kumar-Johnston and Bartle models) in order to present the values of solvation enthalpies in sc-CO 2 and vaporization enthalpies for these compounds. All of these results highlight that semiempirical models can be used for any other purpose as well as modeling (solid + supercritical fluids) equilibria.

  4. Mass spectrometry study of sublimation of rare earth acetylacetonate adducts with hexamethylphosphorustriamide

    International Nuclear Information System (INIS)

    Kuz'mina, N.P.; Semyannikov, P.P.; Martynenko, L.I.; Ch'eu Tkhi Nguet; AN SSSR, Novosibirsk

    1991-01-01

    Process of vacuum sublimation of MA 3 ·Q adducts (M=Nd,Ho,Er; A - -acetylacetonate-ion; Q-hexamethylphosphorustriamide) was studied by mass-spectrometry method. Composinion of gaseous phase, formed in 20-140 deg C range at 10 -5 mm Hg, was determined. Scheme of MA 3 ·Q sublimation, including Q splitting and transition of MA 3 ·Q adducts and MA 3 and Q products of their thermodestruction to gaseous phase, was suggested. ΔH values of MA 3 ·Q thermodestruction and MA 3 sublimation were calculated

  5. The oxidation kinetics for sublimates formed during niobium electron-beam remelting

    International Nuclear Information System (INIS)

    Chumarev, V.M.; Gulyaeva, R.I.; Mar'evich, V.P.; Upolovnikova, A.G.; Udoeva, L.Yu.

    2003-01-01

    The oxidation of sublimates of Nb-Al electron beam remelting is investigated under conditions of isothermal and continuous heating in the air. It is stated that basic oxidation products are niobium and aluminium oxides, as well as aluminium niobates of variable composition of Al 2 O 3 · mNb 2 O 5 . The more aluminium enriched sublimates possess an increased resistance to oxidation. Formed in sublimates NbAl 3 intermetallic compound features the highest heat resistance. Oxidation parameters are determined by the method of nonisothermic kinetics. It is noted that the running processes exhibit a multistage nature and are limited by internal diffusion [ru

  6. Debate on sublime in the end of 18th century: Burke, Kant, Schiller

    Directory of Open Access Journals (Sweden)

    Jeremić-Molnar Dragana

    2009-01-01

    Full Text Available In the article the authors are examining three positions within the 18th Century aesthetic discussion on the sublime - Edmund Burke's, Immanuel Kant's and Friedrich Schiller's. They are also trying to reconstruct the political backgrounds of each of this theoretical positions: old regime conservatism (Burke, republican liberalism (Schiller and romantic longing for the 'third way' (Kant. The most sophisticated and mature theory of sublime is found in Schiller's aesthetic works, especially in those following his disappointment in French Revolution, in which the relationship between sublime and paradoxes of historical violence is most thoroughly reflected.

  7. ZnO sublimation using a polyenergetic pulsed electron beam source: numerical simulation and validation

    Energy Technology Data Exchange (ETDEWEB)

    Tricot, S; Semmar, N; Lebbah, L; Boulmer-Leborgne, C, E-mail: sylvain.tricot@univ-orleans.f [GREMI, UMR 6606-CNRS/Universite d' Orleans, 14 rue d' Issoudun, BP 6744, 45067 Orleans cedex 2 (France)

    2010-02-17

    This paper details the electro-thermal study of the sublimation phase on a zinc oxide surface. This thermodynamic process occurs when a ZnO target is bombarded by a pulsed electron beam source composed of polyenergetic electrons. The source delivers short pulses of 180 ns of electrons with energies up to 16 keV. The beam total current reaches 800 A and is focused onto a spot area 2 mm in diameter. The Monte Carlo CASINO program is used to study the first stage of the interaction and to define the heat source space distribution inside the ZnO target. Simulation of the second stage of interaction is developed in a COMSOL multiphysics project. The simulated thermal field induced by space and time heat conduction is presented. Typically for a pulsed electron beam 2 mm in diameter of electrons having energies up to 16 keV, the surface temperature reaches a maximum of 7000 K. The calculations are supported by SEM pictures of the target irradiated by various beam energies and numbers of pulses.

  8. ZnO sublimation using a polyenergetic pulsed electron beam source: numerical simulation and validation

    International Nuclear Information System (INIS)

    Tricot, S; Semmar, N; Lebbah, L; Boulmer-Leborgne, C

    2010-01-01

    This paper details the electro-thermal study of the sublimation phase on a zinc oxide surface. This thermodynamic process occurs when a ZnO target is bombarded by a pulsed electron beam source composed of polyenergetic electrons. The source delivers short pulses of 180 ns of electrons with energies up to 16 keV. The beam total current reaches 800 A and is focused onto a spot area 2 mm in diameter. The Monte Carlo CASINO program is used to study the first stage of the interaction and to define the heat source space distribution inside the ZnO target. Simulation of the second stage of interaction is developed in a COMSOL multiphysics project. The simulated thermal field induced by space and time heat conduction is presented. Typically for a pulsed electron beam 2 mm in diameter of electrons having energies up to 16 keV, the surface temperature reaches a maximum of 7000 K. The calculations are supported by SEM pictures of the target irradiated by various beam energies and numbers of pulses.

  9. Bion and the sublime: the origins of an aesthetic paradigm.

    Science.gov (United States)

    Civitarese, Giuseppe

    2014-12-01

    In constructing his theory Bion drew on a number of symbolic matrices: psychoanalysis, philosophy, mathematics, literature, aesthetics. The least investigated of these is the last. True, we know that Bion cites many authors of the Romantic period, such as Coleridge, Keats, Blake and Wordsworth, as well as others who were held in high esteem in the Romantic period, such as Milton. However, less is known about the influence exerted on him by the aesthetics of the sublime, which while chronologically preceding Romanticism is in fact one of its components. My working hypothesis is that tracing a number of Bion's concepts back to this secret model can serve several purposes: firstly, it contributes to the study of the sources, and, secondly, it makes these concepts appear much less occasional and idiosyncratic than we might believe, being as they are mostly those less immediately understandable but not less important (O, negative capability, nameless dread, the infinite, the language of achievement, unison etc.). Finally, connecting these notions to a matrix, that is, disclosing the meaning of elements that are not simply juxtaposed but dynamically interrelated, in my view significantly increases not only their theoretical intelligibility but also their usefulness in clinical practice. In conclusion, one could legitimately argue that Bion gradually subsumed all the other paradigms he drew on within the aesthetic paradigm. Copyright © 2014 Institute of Psychoanalysis.

  10. Mimeses do sublime: a recepção de Kant pelo Romantismo e pelo Expressionismo Mimesis of sublime: the Romantism and Expressionism reception of Kant

    Directory of Open Access Journals (Sweden)

    Priscila Rossinetti Rufinoni

    2007-01-01

    Full Text Available Partindo das analises do criticismo kantiano, este texto investiga as concepções romântica e moderna de sublime e de imaginação. Se, por um lado, a concepção romântica inaugura o mundo moderno, por outro, a expressionista mostra os limites dessa mesma modernidade. Para ambas, entretanto, a Crítica do Juízo de Kant é o âmbito privilegiado no qual podemos precisar as distinções.Starting from the analysis of the Kantian criticism, this text investigates the romantic and the modern conceptions of sublime and imagination. On the one hand, the romantic conceptions of sublime inaugurate the modern world. On the other hand, the expressionist conceptions show the confines of this world. The Critique of Judgment is the very locus where such distinctions can be drawn with precision.

  11. Modeling adsorption of cationic surfactants at air/water interface without using the Gibbs equation.

    Science.gov (United States)

    Phan, Chi M; Le, Thu N; Nguyen, Cuong V; Yusa, Shin-ichi

    2013-04-16

    The Gibbs adsorption equation has been indispensable in predicting the surfactant adsorption at the interfaces, with many applications in industrial and natural processes. This study uses a new theoretical framework to model surfactant adsorption at the air/water interface without the Gibbs equation. The model was applied to two surfactants, C14TAB and C16TAB, to determine the maximum surface excesses. The obtained values demonstrated a fundamental change, which was verified by simulations, in the molecular arrangement at the interface. The new insights, in combination with recent discoveries in the field, expose the limitations of applying the Gibbs adsorption equation to cationic surfactants at the air/water interface.

  12. Thermodynamics of sublimation and solvation for bicyclo-derivatives of 1,3-thiazine

    International Nuclear Information System (INIS)

    Ol’khovich, Marina V.; Blokhina, Svetlana V.; Sharapova, Angelica V.; Perlovich, German L.; Proshin, Alexey N.

    2013-01-01

    Highlights: • Temperature dependencies of saturated vapor pressure of new bicyclo-derivatives were obtained. • Thermodynamic functions of sublimation and solvation were calculated. • The correlations between thermodynamic functions and molecular descriptors are discussed. - Abstract: Temperature dependencies of saturated vapor pressure of novel bicyclo-derivatives of 1,3-thiazine with methoxy- and carbonyl-substituents have been obtained by method of transference by means of an inert gas carrier. Thermodynamic functions of sublimation have been calculated. Correlations between thermodynamic functions of sublimation and thermophysical properties of the substances and molecular descriptors have been established. The enthalpies of solvation of compounds were calculated using the measured values of enthalpies of sublimation and of standard enthalpies of solution in hexane and buffer

  13. Potential Identification of Sublimation-Driven Downslope Mass Movement on Mercury

    Science.gov (United States)

    Malliband, C. C.; Conway, S. J.; Rothery, D. A.; Balme, M. R.

    2018-05-01

    We have identified a further example of mass movement, in addition to the previously identified example in the pyroclastic vent NE of Rachmaninoff. Both examples show evidence of hollow sublimation being a cause of the mass movements.

  14. Schiller Goes to the Movies: Locating the Sublime in "Thelma and Louise."

    Science.gov (United States)

    Hoyng, Peter

    1997-01-01

    Endeavors to make students aware of similarities between today's movie culture and the theater of the 18th century; parallels between a traditional drama and a movie script; and Schiller's understanding of the sublime. (36 references) (Author/CK)

  15. Experimental Analysis of Sublimation Dynamics for Buried Glacier Ice in Beacon Valley, Antarctica

    Science.gov (United States)

    Ehrenfeucht, S.; Dennis, D. P.; Marchant, D. R.

    2017-12-01

    The age of the oldest known buried ice in Beacon Valley, McMurdo Dry Valleys (MDV) Antarctica is a topic of active debate due to its implications for the stability of the East Antarctic Ice Sheet. Published age estimates range from as young as 300 ka to as old as 8.1 Ma. In the upland MDV, ablation occurs predominantly via sublimation. The relict ice in question (ancient ice from Taylor Glacier) lies buried beneath a thin ( 30-70 cm) layer of sublimation till, which forms as a lag deposit as underlying debris-rich ice sublimes. As the ice sublimates, the debris held within the ice accumulates slowly on the surface, creating a porous boundary between the buried-ice surface and the atmosphere, which in turn influences gas exchange between the ice and the atmosphere. Additionally, englacial debris adds several salt species that are ultimately concentrated on the ice surface. It is well documented the rate of ice sublimation varies as a function of overlying till thickness. However, the rate-limiting dynamics under varying environmental conditions, including the threshold thicknesses at which sublimation is strongly retarded, are not yet defined. To better understand the relationships between sublimation rate, till thickness, and long-term surface evolution, we build on previous studies by Lamp and Marchant (2017) and evaluate the role of till thickness as a control on ice loss in an environmental chamber capable of replicating the extreme cold desert conditions observed in the MDV. Previous work has shown that this relationship exhibits exponential decay behavior, with sublimation rate significantly dampened under less than 10 cm of till. In our experiments we pay particular attention to the effect of the first several cm of till in order to quantify the dynamics that govern the transition from bare ice to debris-covered ice. We also examine this transition for various forms of glacier ice, including ice with various salt species.

  16. Relationships between fusion, solution, vaporization and sublimation enthalpies of substituted phenols

    International Nuclear Information System (INIS)

    Yagofarov, Mikhail I.; Nagrimanov, Ruslan N.; Solomonov, Boris N.

    2017-01-01

    Highlights: • Method for determination of sublimation and vaporization enthalpies of phenols was developed. • Vaporization enthalpies of 28 phenols at 298 K were calculated. • Sublimation enthalpies of 26 phenols at 298 K were calculated using fusion enthalpies at melting temperatures. • Obtained values are in good agreement with the results of conventional methods. - Abstract: In this work a method for determination of sublimation and vaporization enthalpies of substituted phenols was developed. This method is a modification of solution calorimetry approach. Modification is based on the novel relations, which bind solution, vaporization and sublimation enthalpies at 298.15 K and fusion enthalpy at the melting temperature. According to novel relations the equations for calculating sublimation and vaporization enthalpies at 298.15 K were offered. Calculated values of sublimation and vaporization enthalpies of phenol derivatives containing alkyls, halogens, –OCH 3 , –NO 2 , –COCH 3 , –COOCH 3 groups, and dihydroxybenzenes were compared with literature data (298.15 K) obtained by conventional methods. In most of the cases divergence does not exceed 2–3%.

  17. An Introduction to the DA-T Gibbs Sampler for the Two-Parameter Logistic (2PL Model and Beyond

    Directory of Open Access Journals (Sweden)

    Gunter Maris

    2005-01-01

    Full Text Available The DA-T Gibbs sampler is proposed by Maris and Maris (2002 as a Bayesian estimation method for a wide variety of Item Response Theory (IRT models. The present paper provides an expository account of the DAT Gibbs sampler for the 2PL model. However, the scope is not limited to the 2PL model. It is demonstrated how the DA-T Gibbs sampler for the 2PL may be used to build, quite easily, Gibbs samplers for other IRT models. Furthermore, the paper contains a novel, intuitive derivation of the Gibbs sampler and could be read for a graduate course on sampling.

  18. Comparison of Boltzmann and Gibbs entropies for the analysis of single-chain phase transitions

    Science.gov (United States)

    Shakirov, T.; Zablotskiy, S.; Böker, A.; Ivanov, V.; Paul, W.

    2017-03-01

    In the last 10 years, flat histogram Monte Carlo simulations have contributed strongly to our understanding of the phase behavior of simple generic models of polymers. These simulations result in an estimate for the density of states of a model system. To connect this result with thermodynamics, one has to relate the density of states to the microcanonical entropy. In a series of publications, Dunkel, Hilbert and Hänggi argued that it would lead to a more consistent thermodynamic description of small systems, when one uses the Gibbs definition of entropy instead of the Boltzmann one. The latter is the logarithm of the density of states at a certain energy, the former is the logarithm of the integral of the density of states over all energies smaller than or equal to this energy. We will compare the predictions using these two definitions for two polymer models, a coarse-grained model of a flexible-semiflexible multiblock copolymer and a coarse-grained model of the protein poly-alanine. Additionally, it is important to note that while Monte Carlo techniques are normally concerned with the configurational energy only, the microcanonical ensemble is defined for the complete energy. We will show how taking the kinetic energy into account alters the predictions from the analysis. Finally, the microcanonical ensemble is supposed to represent a closed mechanical N-particle system. But due to Galilei invariance such a system has two additional conservation laws, in general: momentum and angular momentum. We will also show, how taking these conservation laws into account alters the results.

  19. A Gibbs potential expansion with a quantic system made up of a large number of particles

    International Nuclear Information System (INIS)

    Bloch, Claude; Dominicis, Cyrano de

    1959-01-01

    Starting from an expansion derived in a previous work, we study the contribution to the Gibbs potential of the two-body dynamical correlations, taking into account the statistical correlations. Such a contribution is of interest for low density systems at low temperature. In the zero density limit, it reduces to the Beth Uhlenbeck expression of the second virial coefficient. For a system of fermions in the zero temperature limit, it yields the contribution of the Brueckner reaction matrix to the ground state energy, plus, under certain conditions, additional terms of the form exp. (β |Δ|), where the Δ are the binding energies of 'bound states' of the type first discussed by L. Cooper. Finally, we study the wave function of two particles immersed in a medium (defined by its temperature and chemical potential). lt satisfies an equation generalizing the Bethe Goldstone equation for an arbitrary temperature. Reprint of a paper published in 'Nuclear Physics' 10, 1959, p. 181-196 [fr

  20. Rapidly Mixing Gibbs Sampling for a Class of Factor Graphs Using Hierarchy Width.

    Science.gov (United States)

    De Sa, Christopher; Zhang, Ce; Olukotun, Kunle; Ré, Christopher

    2015-12-01

    Gibbs sampling on factor graphs is a widely used inference technique, which often produces good empirical results. Theoretical guarantees for its performance are weak: even for tree structured graphs, the mixing time of Gibbs may be exponential in the number of variables. To help understand the behavior of Gibbs sampling, we introduce a new (hyper)graph property, called hierarchy width . We show that under suitable conditions on the weights, bounded hierarchy width ensures polynomial mixing time. Our study of hierarchy width is in part motivated by a class of factor graph templates, hierarchical templates , which have bounded hierarchy width-regardless of the data used to instantiate them. We demonstrate a rich application from natural language processing in which Gibbs sampling provably mixes rapidly and achieves accuracy that exceeds human volunteers.

  1. The MaxEnt extension of a quantum Gibbs family, convex geometry and geodesics

    International Nuclear Information System (INIS)

    Weis, Stephan

    2015-01-01

    We discuss methods to analyze a quantum Gibbs family in the ultra-cold regime where the norm closure of the Gibbs family fails due to discontinuities of the maximum-entropy inference. The current discussion of maximum-entropy inference and irreducible correlation in the area of quantum phase transitions is a major motivation for this research. We extend a representation of the irreducible correlation from finite temperatures to absolute zero

  2. Uniqueness of Gibbs Measure for Models with Uncountable Set of Spin Values on a Cayley Tree

    International Nuclear Information System (INIS)

    Eshkabilov, Yu. Kh.; Haydarov, F. H.; Rozikov, U. A.

    2013-01-01

    We consider models with nearest-neighbor interactions and with the set [0, 1] of spin values, on a Cayley tree of order K ≥ 1. It is known that the ‘splitting Gibbs measures’ of the model can be described by solutions of a nonlinear integral equation. For arbitrary k ≥ 2 we find a sufficient condition under which the integral equation has unique solution, hence under the condition the corresponding model has unique splitting Gibbs measure.

  3. A SHORT-DURATION EVENT AS THE CAUSE OF DUST EJECTION FROM MAIN-BELT COMET P/2012 F5 (GIBBS)

    Energy Technology Data Exchange (ETDEWEB)

    Moreno, F. [Instituto de Astrofisica de Andalucia, CSIC, Glorieta de la Astronomia s/n, E-18008 Granada (Spain); Licandro, J.; Cabrera-Lavers, A., E-mail: fernando@iaa.es [Instituto de Astrofisica de Canarias, c/Via Lactea s/n, E-38200 La Laguna, Tenerife (Spain)

    2012-12-10

    We present observations and an interpretative model of the dust environment of the Main-Belt Comet P/2010 F5 (Gibbs). The narrow dust trails observed can be interpreted unequivocally as an impulsive event that took place around 2011 July 1 with an uncertainty of {+-}10 days, and a duration of less than a day, possibly of the order of a few hours. The best Monte Carlo dust model fits to the observed trail brightness imply ejection velocities in the range 8-10 cm s{sup -1} for particle sizes between 30 cm and 130 {mu}m. This weak dependence of velocity on size contrasts with that expected from ice sublimation and agrees with that found recently for (596) Scheila, a likely impacted asteroid. The particles seen in the trail are found to follow a power-law size distribution of index Almost-Equal-To -3.7. Assuming that the slowest particles were ejected at the escape velocity of the nucleus, its size is constrained to about 200-300 m in diameter. The total ejected dust mass is {approx}> 5 Multiplication-Sign 10{sup 8} kg, which represents approximately 4%-20% of the nucleus mass.

  4. The impacts of moisture transport on drifting snow sublimation in the saltation layer

    Directory of Open Access Journals (Sweden)

    N. Huang

    2016-06-01

    Full Text Available Drifting snow sublimation (DSS is an important physical process related to moisture and heat transfer that happens in the atmospheric boundary layer, which is of glaciological and hydrological importance. It is also essential in order to understand the mass balance of the Antarctic ice sheets and the global climate system. Previous studies mainly focused on the DSS of suspended snow and ignored that in the saltation layer. Here, a drifting snow model combined with balance equations for heat and moisture is established to simulate the physical DSS process in the saltation layer. The simulated results show that DSS can strongly increase humidity and cooling effects, which in turn can significantly reduce DSS in the saltation layer. However, effective moisture transport can dramatically weaken the feedback effects. Due to moisture advection, DSS rate in the saltation layer can be several orders of magnitude greater than that of the suspended particles. Thus, DSS in the saltation layer has an important influence on the distribution and mass–energy balance of snow cover.

  5. Modelling of pulsed electron beam induced graphite ablation: Sublimation versus melting

    Science.gov (United States)

    Ali, Muddassir; Henda, Redhouane

    2017-12-01

    Pulsed electron beam ablation (PEBA) has recently emerged as a very promising technique for the deposition of thin films with superior properties. Interaction of the pulsed electron beam with the target material is a complex process, which consists of heating, phase transition, and erosion of a small portion from the target surface. Ablation can be significantly affected by the nature of thermal phenomena taking place at the target surface, with subsequent bearing on the properties, stoichiometry and structure of deposited thin films. A two stage, one-dimensional heat conduction model is presented to describe two different thermal phenomena accounting for interaction of a graphite target with a polyenergetic electron beam. In the first instance, the thermal phenomena are comprised of heating, melting and vaporization of the target surface, while in the second instance the thermal phenomena are described in terms of heating and sublimation of the graphite surface. In this work, the electron beam delivers intense electron pulses of ∼100 ns with energies up to 16 keV and an electric current of ∼400 A to a graphite target. The temperature distribution, surface recession velocity, ablated mass per unit area, and ablation depth for the graphite target are numerically simulated by the finite element method for each case. Based on calculation findings and available experimental data, ablation appears to occur mainly in the regime of melting and vaporization from the surface.

  6. Boiling point determination using adiabatic Gibbs ensemble Monte Carlo simulations: application to metals described by embedded-atom potentials.

    Science.gov (United States)

    Gelb, Lev D; Chakraborty, Somendra Nath

    2011-12-14

    The normal boiling points are obtained for a series of metals as described by the "quantum-corrected Sutton Chen" (qSC) potentials [S.-N. Luo, T. J. Ahrens, T. Çağın, A. Strachan, W. A. Goddard III, and D. C. Swift, Phys. Rev. B 68, 134206 (2003)]. Instead of conventional Monte Carlo simulations in an isothermal or expanded ensemble, simulations were done in the constant-NPH adabatic variant of the Gibbs ensemble technique as proposed by Kristóf and Liszi [Chem. Phys. Lett. 261, 620 (1996)]. This simulation technique is shown to be a precise tool for direct calculation of boiling temperatures in high-boiling fluids, with results that are almost completely insensitive to system size or other arbitrary parameters as long as the potential truncation is handled correctly. Results obtained were validated using conventional NVT-Gibbs ensemble Monte Carlo simulations. The qSC predictions for boiling temperatures are found to be reasonably accurate, but substantially underestimate the enthalpies of vaporization in all cases. This appears to be largely due to the systematic overestimation of dimer binding energies by this family of potentials, which leads to an unsatisfactory description of the vapor phase. © 2011 American Institute of Physics

  7. A study of the Boltzmann and Gibbs entropies in the context of a stochastic toy model

    Science.gov (United States)

    Malgieri, Massimiliano; Onorato, Pasquale; De Ambrosis, Anna

    2018-05-01

    In this article we reconsider a stochastic toy model of thermal contact, first introduced in Onorato et al (2017 Eur. J. Phys. 38 045102), showing its educational potential for clarifying some current issues in the foundations of thermodynamics. The toy model can be realized in practice using dice and coins, and can be seen as representing thermal coupling of two subsystems with energy bounded from above. The system is used as a playground for studying the different behaviours of the Boltzmann and Gibbs temperatures and entropies in the approach to steady state. The process that models thermal contact between the two subsystems can be proved to be an ergodic, reversible Markov chain; thus the dynamics produces an equilibrium distribution in which the weight of each state is proportional to its multiplicity in terms of microstates. Each one of the two subsystems, taken separately, is formally equivalent to an Ising spin system in the non-interacting limit. The model is intended for educational purposes, and the level of readership of the article is aimed at advanced undergraduates.

  8. Distributed modelling of climate change impacts on snow sublimation in Northern Mongolia

    Directory of Open Access Journals (Sweden)

    L. Menzel

    2009-08-01

    Full Text Available Sublimation of snow is an important factor of the hydrological cycle in Mongolia and is likely to increase according to future climate projections. In this study the hydrological model TRAIN was used to assess spatially distributed current and future sublimation rates based on interpolated daily data of precipitation, air temperature, air humidity, wind speed and solar radiation. An automated procedure for the interpolation of the input data is provided. Depending on the meteorological parameter and the data availability for the individual days, the most appropriate interpolation method is chosen automatically from inverse distance weighting, Ordinary Least Squares interpolation, Ordinary or Universal Kriging. Depending on elevation simulated annual sublimation in the period 1986–2006 was 23 to 35 mm, i.e. approximately 80% of total snowfall. Moreover, future climate projections for 2071–2100 of ECHAM5 and HadCM3, based on the A1B emission scenario of the Intergovernmental Panel on Climate Change, were analysed with TRAIN. In the case of ECHAM5 simulated sublimation increases by up to 17% (26...41 mm while it remains at the same level for HadCM3 (24...34 mm. The differences are mainly due to a distinct increase in winter precipitation for ECHAM5. Simulated changes of the all-season hydrological conditions, e.g. the sublimation-to-precipitation ratio, were ambiguous due to diverse precipitation patterns derived by the global circulation models.

  9. Experiments On Sublimating Carbon Dioxide Ice And Implications For Contemporary Surface Processes On Mars.

    Science.gov (United States)

    Mc Keown, L E; Bourke, M C; McElwaine, J N

    2017-10-27

    Carbon dioxide is Mars' primary atmospheric constituent and is an active driver of Martian surface evolution. CO 2 ice sublimation mechanisms have been proposed for a host of features that form in the contemporary Martian climate. However, there has been very little experimental work or quantitative modelling to test the validity of these hypotheses. Here we present the results of the first laboratory experiments undertaken to investigate if the interaction between sublimating CO 2 ice blocks and a warm, porous, mobile regolith can generate features similar in morphology to those forming on Martian dunes today. We find that CO 2 sublimation can mobilise grains to form (i) pits and (ii) furrows. We have documented new detached pits at the termini of linear gullies on Martian dunes. Based on their geomorphic similarity to the features observed in our laboratory experiments, and on scaling arguments, we propose a new hypothesis that detached pits are formed by the impact of granular jets generated by sublimating CO 2 . We also study the erosion patterns formed underneath a sublimating block of CO 2 ice and demonstrate that these resemble furrow patterns on Mars, suggesting similar formation mechanisms.

  10. Gibbs-Thomson Law for Singular Step Segments: Thermodynamics Versus Kinetics

    Science.gov (United States)

    Chernov, A. A.

    2003-01-01

    Classical Burton-Cabrera-Frank theory presumes that thermal fluctuations are so fast that at any time density of kinks on a step is comparable with the reciprocal intermolecular distance, so that the step rate is about isotropic within the crystal plane. Such azimuthal isotropy is, however, often not the case: Kink density may be much lower. In particular, it was recently found on the (010) face of orthorhombic lysozyme that interkink distance may exceed 500-600 intermolecular distances. Under such conditions, Gibbs-Thomson law (GTL) may not be applicable: On a straight step segment between two corners, communication between the comers occurs exclusively by kink exchange. Annihilation between kinks of opposite sign generated at the comers results in the grain in step energy entering GTL. If the step segment length l much greater than D/v, where D and v are the kink diffusivity and propagation rate, respectively, the opposite kinks have practically no chance to annihilate and GTL is not applicable. The opposite condition of the GTL applicability, l much less than D/v, is equivalent to the requirement that relative supersaturation Delta(sub mu)/kT much less than alpha/l, where alpha is molecular size. Thus, GTL may be applied to a segment of 10(exp 3)alpha approx. 3 x 10(exp -5)cm approx 0.3 micron only if supersaturation is less than 0.1%, while practically used driving forces for crystallization are much larger. Relationships alternative to the GTL for different, but low, kink density have been discussed. They confirm experimental evidences that the Burton-Cabrera-Frank theory of spiral growth is growth rates twice as low as compared to the observed figures. Also, application of GTL results in unrealistic step energy while suggested kinetic law give reasonable figures.

  11. Blowing snow sublimation and transport over Antarctica from 11 years of CALIPSO observations

    Directory of Open Access Journals (Sweden)

    S. P. Palm

    2017-11-01

    Full Text Available Blowing snow processes commonly occur over the earth's ice sheets when the 10 m wind speed exceeds a threshold value. These processes play a key role in the sublimation and redistribution of snow thereby influencing the surface mass balance. Prior field studies and modeling results have shown the importance of blowing snow sublimation and transport on the surface mass budget and hydrological cycle of high-latitude regions. For the first time, we present continent-wide estimates of blowing snow sublimation and transport over Antarctica for the period 2006–2016 based on direct observation of blowing snow events. We use an improved version of the blowing snow detection algorithm developed for previous work that uses atmospheric backscatter measurements obtained from the CALIOP (Cloud-Aerosol Lidar with Orthogonal Polarization lidar aboard the CALIPSO (Cloud-Aerosol Lidar and Infrared Pathfinder Satellite Observation satellite. The blowing snow events identified by CALIPSO and meteorological fields from MERRA-2 are used to compute the blowing snow sublimation and transport rates. Our results show that maximum sublimation occurs along and slightly inland of the coastline. This is contrary to the observed maximum blowing snow frequency which occurs over the interior. The associated temperature and moisture reanalysis fields likely contribute to the spatial distribution of the maximum sublimation values. However, the spatial pattern of the sublimation rate over Antarctica is consistent with modeling studies and precipitation estimates. Overall, our results show that the 2006–2016 Antarctica average integrated blowing snow sublimation is about 393 ± 196 Gt yr−1, which is considerably larger than previous model-derived estimates. We find maximum blowing snow transport amount of 5 Mt km−1 yr−1 over parts of East Antarctica and estimate that the average snow transport from continent to ocean is about 3.7 Gt yr−1. These

  12. Vacuum sublimation of interaction products of neodymium and erbium dipivaloyl methanates with pivalic acid

    International Nuclear Information System (INIS)

    Tu, Z.A.; Kuz'mina, N.P.; Martynenko, L.I.

    1993-01-01

    Processes taking place during vacuum sublimation of solid complexes of individual rare earths prepared in the systems MDpm 3 -nHPiv-hexane (M = Nd, Er, HDpm - dipivaloylmethane, HPiv - pivalic acid, n = 1, 2, 3) were studied. It is pointed out that at n = 1 in the systems considered mixed ligand complexes of the composition ErDpm 3 · HPiv and NdDpm 2 Piv are formed which disproportionate at different temperatures when heated in vacuum. It is revealed that the processes of the complexes disproportionation can be used to increase the efficiency of sublimation methods of neodymium and erbium dipivaloylmethanates mixture separation. 6 refs., 2 figs., 1 tab

  13. Determination of vapor pressures, enthalpies of sublimation, and enthalpies of fusion of benzenetriols

    International Nuclear Information System (INIS)

    Verevkin, Sergey P.; Schick, Christoph

    2004-01-01

    Molar enthalpies of sublimation of 1,2,4-, 1,2,3-, and 1,3,5-tri-hydroxy-benzene, were obtained from the temperature dependence of the vapor pressure measured by the transpiration method. The molar enthalpies of fusion and molar heat capacities of these compounds were measured by DSC. The measured data sets of vaporization, sublimation and fusion enthalpies were checked for internal consistency. Strength of the inter- and intra-molecular hydrogen bonding in di- and tri-hydroxy-benzenes have been assessed

  14. Numerical implementation and oceanographic application of the Gibbs thermodynamic potential of seawater

    Directory of Open Access Journals (Sweden)

    R. Feistel

    2005-01-01

    Full Text Available The 2003 Gibbs thermodynamic potential function represents a very accurate, compact, consistent and comprehensive formulation of equilibrium properties of seawater. It is expressed in the International Temperature Scale ITS-90 and is fully consistent with the current scientific pure water standard, IAPWS-95. Source code examples in FORTRAN, C++ and Visual Basic are presented for the numerical implementation of the potential function and its partial derivatives, as well as for potential temperature. A collection of thermodynamic formulas and relations is given for possible applications in oceanography, from density and chemical potential over entropy and potential density to mixing heat and entropy production. For colligative properties like vapour pressure, freezing points, and for a Gibbs potential of sea ice, the equations relating the Gibbs function of seawater to those of vapour and ice are presented.

  15. Existence and uniqueness of Gibbs states for a statistical mechanical polyacetylene model

    International Nuclear Information System (INIS)

    Park, Y.M.

    1987-01-01

    One-dimensional polyacetylene is studied as a model of statistical mechanics. In a semiclassical approximation the system is equivalent to a quantum XY model interacting with unbounded classical spins in one-dimensional lattice space Z. By establishing uniform estimates, an infinite-volume-limit Hilbert space, a strongly continuous time evolution group of unitary operators, and an invariant vector are constructed. Moreover, it is proven that any infinite-limit state satisfies Gibbs conditions. Finally, a modification of Araki's relative entropy method is used to establish the uniqueness of Gibbs states

  16. Improved prediction of MHC class I and class II epitopes using a novel Gibbs sampling approach

    DEFF Research Database (Denmark)

    Nielsen, Morten; Lundegaard, Claus; Worning, Peder

    2004-01-01

    Prediction of which peptides will bind a specific major histocompatibility complex (MHC) constitutes an important step in identifying potential T-cell epitopes suitable as vaccine candidates. MHC class II binding peptides have a broad length distribution complicating such predictions. Thus......, identifying the correct alignment is a crucial part of identifying the core of an MHC class II binding motif. In this context, we wish to describe a novel Gibbs motif sampler method ideally suited for recognizing such weak sequence motifs. The method is based on the Gibbs sampling method, and it incorporates...

  17. How to Kill a Journalism School: The Digital Sublime in the Discourse of Discontinuance

    Science.gov (United States)

    McDevitt, Michael; Sindorf, Shannon

    2012-01-01

    The authors argue that journalism's uncertain identity in academia has made it vulnerable to unreflective instrumentalism in the digital era. They show how instrumentalism intertwined with the digital sublime constitutes a rhetorically resonate rationale for closing a journalism school. Evidence comes from documents and testimony associated with…

  18. A re-determination and re-assessment of the thermodynamics of sublimation of uranium dioxide

    International Nuclear Information System (INIS)

    Ackermann, R.J.; Rauh, E.G.; Rand, M.H.

    1980-01-01

    New mass-spectrometric measurements on the ion-intensity of UO 2 + over urania from 1813 to 2463 K are reported. Although the mean value for the enthalpy of sublimation calculated from these measurements is close to previous values, a detailed examination of the results indicates that there is an appreciable curvature in the log p versus reciprocal-temperature curve for the process: UO 2 (s)→UO 2 (g). This is attributed to a large negative ΔCsub(p) for the sublimation reaction, arising from the sharp increase in Csub(p) (UO 2 (s)) above approximately 1750 K. A thorough re-assessment of the previous studies on the sublimation of urania suggests an 'international' average value of psub(UO 2 )=(1.3+-0.1)x10 -6 atm at 2150 K; Knudsen effusion measurements above 2450 K (p>1x10 -4 atm) are thought to be in error due to departures from molecular flow. Thermal functions for UO 2 (g) have been calculated, assuming a linear molecule and electronic contributions to the partition function based on those of ThO(g). Anharmonicity corrections have been included. When these functions are combined with the thermal functions for UO 2 (s), recently assessed, the third law heat of sublimation at 298.15 K becomes 147.8 kcal.mol -1 with a trend of only 0.2 kcal.mol -1 across the temperature range 1800 to 2400 K. (author)

  19. Structure-property relationships in halogenbenzoic acids: Thermodynamics of sublimation, fusion, vaporization and solubility.

    Science.gov (United States)

    Zherikova, Kseniya V; Svetlov, Aleksey A; Kuratieva, Natalia V; Verevkin, Sergey P

    2016-10-01

    Temperature dependences of vapor pressures for 2-, 3-, and 4-bromobenzoic acid, as well as for five isomeric bromo-methylbenzoic acids were studied by the transpiration method. Melting temperatures and enthalpies of fusion for all isomeric bromo-methylbenzoic acids and 4-bromobenzoic acid were measured with a DSC. The molar enthalpies of sublimation and vaporization were derived. These data together with results available in the literature were collected and checked for internal consistency using a group-additivity procedure and results from X-ray structural diffraction studies. Specific (hydrogen bonding) interactions in the liquid and in the crystal phase of halogenbenzoic acids were quantified based on experimental values of vaporization and sublimation enthalpies. Structure-property correlations of solubilities of halogenobenzoic acids with sublimation pressures and sublimation enthalpies were developed and solubilities of bromo-benzoic acids were estimated. These new results resolve much of the ambiguity in the available thermochemical and solubility data on bromobenzoic acids. The approach based on structure property correlations can be applied for the assessment of water solubility of sparingly soluble drugs. Copyright © 2016 Elsevier Ltd. All rights reserved.

  20. Application of ion beam analysis to the selective sublimation processing of thin films for gas sensing

    International Nuclear Information System (INIS)

    Vomiero, A.; Scian, C.; Della Mea, G.; Guidi, V.; Martinelli, G.; Schiffrer, G.; Comini, E.; Ferroni, M.; Sberveglieri, G.

    2006-01-01

    Ion beam analysis was successfully applied to a novel technique, named selective sublimation process (SSP), for deposition of nanostructured gas-sensing films through reactive sputtering. The method consists of the co-deposition of a mixed oxide, one of which has a relatively low sublimation temperature. Annealing at suitable temperature causes the sublimation of the most volatile compound, leaving a layer with adjustable composition. The appropriate choice of thermal treatments and the consequent tailoring of the composition play a crucial role in the determination of the microstructural properties. We developed a model based on diffusion equations that provides a useful guide to control the deposition and processing parameters and we applied the model on the systems TiO 2 -WO 3 and TiO 2 -MoO 3 . Rutherford backscattering (RBS) was demonstrated to be effective for the characterization of the diffusion and sublimation processes during SSP. Experimental results fully agree with theoretical prediction, and allowed the calculation of all the parameters involved in SSP

  1. Glacier mass balance reconstruction by sublimation induced enrichment of chemical species on Cerro Tapado (Chilean Andes

    Directory of Open Access Journals (Sweden)

    P. Ginot

    2006-01-01

    Full Text Available A 36 m long ice core down to bedrock from the Cerro Tapado glacier (5536 m a.s.l, 30°08' S, 69°55' W was analyzed to reconstruct past climatic conditions for Northern Chile. Because of the marked seasonality in the precipitation (short wet winter and extended dry summer periods in this region, major snow ablation and related post-depositional processes occur on the glacier surface during summer periods. They include predominantly sublimation and dry deposition. Assuming that, like measured during the field campaign, the enrichment of chloride was always related to sublimation, the chemical record along the ice core may be applied to reconstruct the history of such secondary processes linked to the past climatic conditions over northern Chile. For the time period 1962–1999, a mean annual net accumulation of 316 mm water equivalent (weq and 327 mm weq loss by sublimation was deduced by this method. This corresponds to an initial total annual accumulation of 539 mm weq. The annual variability of the accumulation and sublimation is related with the Southern Oscillation Index (SOI: higher net-accumulation during El-Niño years and more sublimation during La Niña years. The deepest part of the ice record shows a time discontinuity; with an ice body deposited under different climatic conditions: 290 mm higher precipitation but with reduced seasonal distribution (+470 mm in winter and –180 mm in summer and –3°C lower mean annual temperature. Unfortunately, its age is unknown. The comparison with regional proxy data however let us conclude that the glacier buildup did most likely occur after the dry mid-Holocene.

  2. Discrete tomographic reconstruction of 2D polycrystal orientation maps from X-ray diffraction projections using Gibbs priors

    DEFF Research Database (Denmark)

    Rodek, L.; Knudsen, E.; Poulsen, H.F.

    2005-01-01

    discrete tomographic algorithm, applying image-modelling Gibbs priors and a homogeneity condition. The optimization of the objective function is accomplished via the Gibbs Sampler in conjunction with simulated annealing. In order to express the structure of the orientation map, the similarity...

  3. Experimental Pragmatics and What Is Said: A Response to Gibbs and Moise.

    Science.gov (United States)

    Nicolle, Steve; Clark, Billy

    1999-01-01

    Attempted replication of Gibbs and Moise (1997) experiments regarding the recognition of a distinction between what is said and what is implicated. Results showed that, under certain conditions, subject selected implicatures when asked to select the paraphrase best reflecting what a speaker has said. Suggests that results can be explained with the…

  4. Uniqueness of Gibbs states and global Markov property for Euclidean fields

    International Nuclear Information System (INIS)

    Albeverio, S.; Hoeegh-Krohn, R.

    1981-01-01

    The authors briefly discuss the proof of the uniqueness of solutions of the DLR equations (uniqueness of Gibbs states) in the class of regular generalized random fields (in the sense of having second moments bounded by those of some Euclidean field), for the Euclidean fields with trigonometric interaction. (Auth.)

  5. Fast covariance estimation for innovations computed from a spatial Gibbs point process

    DEFF Research Database (Denmark)

    Coeurjolly, Jean-Francois; Rubak, Ege

    In this paper, we derive an exact formula for the covariance of two innovations computed from a spatial Gibbs point process and suggest a fast method for estimating this covariance. We show how this methodology can be used to estimate the asymptotic covariance matrix of the maximum pseudo...

  6. On P-Adic Quasi Gibbs Measures for Q + 1-State Potts Model on the Cayley Tree

    International Nuclear Information System (INIS)

    Mukhamedov, Farrukh

    2010-06-01

    In the present paper we introduce a new class of p-adic measures, associated with q +1-state Potts model, called p-adic quasi Gibbs measure, which is totally different from the p-adic Gibbs measure. We establish the existence p-adic quasi Gibbs measures for the model on a Cayley tree. If q is divisible by p, then we prove the occurrence of a strong phase transition. If q and p are relatively prime, then there is a quasi phase transition. These results are totally different from the results of [F.M.Mukhamedov, U.A. Rozikov, Indag. Math. N.S. 15(2005) 85-100], since q is divisible by p, which means that q + 1 is not divided by p, so according to a main result of the mentioned paper, there is a unique and bounded p-adic Gibbs measure (different from p-adic quasi Gibbs measure). (author)

  7. Equilibrium statistical mechanics for self-gravitating systems: local ergodicity and extended Boltzmann-Gibbs/White-Narayan statistics

    Science.gov (United States)

    He, Ping

    2012-01-01

    The long-standing puzzle surrounding the statistical mechanics of self-gravitating systems has not yet been solved successfully. We formulate a systematic theoretical framework of entropy-based statistical mechanics for spherically symmetric collisionless self-gravitating systems. We use an approach that is very different from that of the conventional statistical mechanics of short-range interaction systems. We demonstrate that the equilibrium states of self-gravitating systems consist of both mechanical and statistical equilibria, with the former characterized by a series of velocity-moment equations and the latter by statistical equilibrium equations, which should be derived from the entropy principle. The velocity-moment equations of all orders are derived from the steady-state collisionless Boltzmann equation. We point out that the ergodicity is invalid for the whole self-gravitating system, but it can be re-established locally. Based on the local ergodicity, using Fermi-Dirac-like statistics, with the non-degenerate condition and the spatial independence of the local microstates, we rederive the Boltzmann-Gibbs entropy. This is consistent with the validity of the collisionless Boltzmann equation, and should be the correct entropy form for collisionless self-gravitating systems. Apart from the usual constraints of mass and energy conservation, we demonstrate that the series of moment or virialization equations must be included as additional constraints on the entropy functional when performing the variational calculus; this is an extension to the original prescription by White & Narayan. Any possible velocity distribution can be produced by the statistical-mechanical approach that we have developed with the extended Boltzmann-Gibbs/White-Narayan statistics. Finally, we discuss the questions of negative specific heat and ensemble inequivalence for self-gravitating systems.

  8. A Gibbs potential expansion with a quantic system made up of a large number of particles; Un developpement du potentiel de Gibbs d'un systeme compose d'un grand nombre de particules

    Energy Technology Data Exchange (ETDEWEB)

    Bloch, Claude; Dominicis, Cyrano de [Commissariat a l' energie atomique et aux energies alternatives - CEA, Centre d' Etudes Nucleaires de Saclay, Gif-sur-Yvette (France)

    1959-07-01

    Starting from an expansion derived in a previous work, we study the contribution to the Gibbs potential of the two-body dynamical correlations, taking into account the statistical correlations. Such a contribution is of interest for low density systems at low temperature. In the zero density limit, it reduces to the Beth Uhlenbeck expression of the second virial coefficient. For a system of fermions in the zero temperature limit, it yields the contribution of the Brueckner reaction matrix to the ground state energy, plus, under certain conditions, additional terms of the form exp. (β |Δ|), where the Δ are the binding energies of 'bound states' of the type first discussed by L. Cooper. Finally, we study the wave function of two particles immersed in a medium (defined by its temperature and chemical potential). lt satisfies an equation generalizing the Bethe Goldstone equation for an arbitrary temperature. Reprint of a paper published in 'Nuclear Physics' 10, 1959, p. 181-196 [French] Partant d'un developpement extrait d'un precedent travail, nous etudions la contribution au potentiel de Gibbs des relations dynamiques du systeme de deux corps, en tenant compte des relations statistiques. Une telle contribution presente de l'interet pour les systemes a densite faible et a basse temperature. A la densite limite zero, elle se ramene a l'expression de Beth Uhlenbeck du second coefficient virial. Pour un systeme de fermions a la temperature limite zero, il produit la contribution de la matrice de reaction de Brueckner au niveau fondamental, plus, dans certaines conditions, des termes additionnels de la forme exp. (β |Δ|), ou les Δ sont les energies de liaison des 'etats lies' du premier type, discutes auparavant par L. Cooper. Finalement, on etudie la fonction d'onde de deux particules immerges dans un milieu (definie par sa temperature et son potentiel chimique). Il satisfait a une equation generalisant l'equation de Bethe Goldstone pour une temperature arbitraire

  9. Orbital Evolution of Dust Particles in the Sublimation Zone near the Sun

    Science.gov (United States)

    Shestakova, L. I.; Demchenko, B. I.

    2018-03-01

    We have performed the calculations of the orbital evolution of dust particles from volcanic glass ( p-obsidian), basalt, astrosilicate, olivine, and pyroxene in the sublimation zone near the Sun. The sublimation (evaporation) rate is determined by the temperature of dust particles depending on their radius, material, and distance to the Sun. All practically important parameters that characterize the interaction of spherical dust particles with the radiation are calculated using the Mie theory. The influence of radiation and solar wind pressure, as well as the Poynting-Robertson drag force effects on the dust dynamics, are also taken into account. According to the observations (Shestakova and Demchenko, 2016), the boundary of the dust-free zone is 7.0-7.6 solar radii for standard particles of the zodiacal cloud and 9.1-9.2 solar radii for cometary particles. The closest agreement is obtained for basalt particles and certain kinds of olivine, pyroxene, and volcanic glass.

  10. Concurrent freezing and sublimation of a liquid-saturated porous slab

    International Nuclear Information System (INIS)

    Vaidyanathan, N.; Shamsundar, N.

    1991-01-01

    In this paper analytical models are formulated for describing heat and mass transport during concurrent freezing and sublimation of a one-dimensional liquid-saturated porous slab. The models are based on transient heat transfer in the frozen and wet regions, and quasi-steady heat and mass transfer in the dried region. The enthalpy method in conjunction with a fully implicit finite-difference scheme is employed to obtain the solution in the frozen and wet regions. A quasi-steady solution is used in the dried region. The governing equations are nondimensionalized and parametric studies are performed. The results indicate that the Luikov number, the ambient vapor pressure, and the heat transfer Biot number are important parameters. The results also confirm that the sublimation interface temperature may show significant variations, in contrast to earlier studies in which it was assumed constant

  11. Poetiche del sublime. Il Coro di morti dalle Operette morali a Goffredo Petrassi

    Directory of Open Access Journals (Sweden)

    Giovanni Vito Distefano

    2018-01-01

    Full Text Available In un autore come Leopardi, incline al serio in misura apparentemente esclusiva e poco votato all’arte drammatica, è tuttavia in un piccolo capolavoro tragicomico che possono individuarsi le prime tracce di una moderna estetica del sublime. L’articolo propone innanzitutto una lettura in chiave metapoetica del Coro di morti, volta ad osservare la salda convergenza che nella scrittura leopardiana lega reciporcamente gli avanzamenti del pensiero – la verità di una condizione umana irresolubilmente e incomprensibilmente priva della felicità – e gli sviluppi attinenti al piano formale e a quello della riflessione filosofico-estetica – con la messa in discussione tanto della classicistica estetica della mimesis, quanto di quella romantica del sentimentale. Infine, nella seconda parte, il paradigma estetico del sublime fornirà i termini entro i quali tracciare una ricostruzione del procedimento adattivo che lega all’originale leopardiano la trasposizione musicale realizzata nel 1941 da Goffredo Petrassi.

  12. Thermodynamic study of sublimation, melting and vaporization of scandium(III) dipivaloylmethanate derivatives

    International Nuclear Information System (INIS)

    Zherikova, Kseniya V.; Zelenina, Ludmila N.; Chusova, Tamara P.; Gelfond, Nikolay V.; Morozova, Natalia B.

    2016-01-01

    Highlights: • Thermal properties of two volatile fluorinated Sc(III) beta-diketonates were studied. • Saturated and unsaturated vapor pressures were measured. • DSC analysis was carried out. • Sublimation, evaporation and melting enthalpies and entropies were derived. • Effect of fluorine introduction on volatility and thermal stability was established. - Abstract: The present work deals with the investigation of thermal properties of two volatile scandium(III) beta-diketonates with 2,2,6,6-tetramethyl-4-fluoro-3,5-heptanedione and 1,1,1-trifluoro-5,5-dimethyl-2,4-hexanedione which have been synthesized and purified. Using the static method with glass membrane gauge-manometer the temperature dependencies of saturated and unsaturated vapor pressure were measured for the first time. The temperatures and enthalpies of melting were measured for these compounds by differential scanning calorimetry. The standard thermodynamic characteristics of enthalpy and entropy for sublimation, vaporization and melting processes were derived.

  13. Titanium sublimation pumping systems and performances on the Tandem Mirror Experiment-Upgrade (TMX-U)

    International Nuclear Information System (INIS)

    Pico, R.E.

    1986-01-01

    This paper presents a brief history of the TMX-U Titanium Sublimation Pumping process (gettering). Titanium sublimation pumps offer an economical means of pumping chemically active gases (especially hydrogen) at high speeds, and serves as additional pumps, along with liquid nitrogen-cooled panels, to provide pumping during each physics experiment. Because of the size of the system, a complex computer program was written which is run-time compiled, and then run by the computer. With the multi-tasking capability of the computer, five programs are used in operation and run simultaneously. All getter wire history, deposition, and system notes are stored on the external disc drive. The progress and performance in the four years the system has been used, two year manually controlled, and two computer controlled with be covered. Emphasis on the computer control system and its by-products, which enhance the operation of the TMX-U, will be the subject of this paper

  14. Practical sublimation source for large-scale chromium gettering in fusion devices

    Energy Technology Data Exchange (ETDEWEB)

    Simpkins, J E; Gabbard, W A; Emerson, L C; Mioduszewski, P K [Oak Ridge National Lab., TN (USA)

    1984-05-01

    This paper describe the fabrication and testing of a large-scale chromium sublimation source that resembles the VARIAN Ti-ballsup(TM) in its design. The device consists of a hollow chromium sphere with a diameter of approximately 3 cm and an incandescent filament for radiation heating from inside the ball. We also discuss the gettering technique utilizing this source. The experimental arrangement consists of an ultrahigh vacuum (UHV) system instrumented for total and partial pressure measurements, a film thickness monitor, thermocouples, an optical pyrometer, and appropriate instrumentation to measure the heating power. The results show the temperature and corresponding sublimation rate of the Cr-ball as functions of input power. In addition, an example of the total pumping speed of a gettered surface is shown.

  15. A practical sublimation source for large-scale chromium gettering in fusion devices

    International Nuclear Information System (INIS)

    Simpkins, J.E.; Gabbard, W.A.; Emerson, L.C.; Mioduszewski, P.K.

    1984-01-01

    This paper describe the fabrication and testing of a large-scale chromium sublimation source that resembles the VARIAN Ti-ballsup(TM) in its design. The device consists of a hollow chromium sphere with a diameter of approximately 3 cm and an incandescent filament for radiation heating from inside the ball. We also discuss the gettering technique utilizing this source. The experimental arrangement consists of an ultrahigh vacuum (UHV) system instrumented for total and partial pressure measurements, a film thickness monitor, thermocouples, an optical pyrometer, and appropriate instrumentation to measure the heating power. The results show the temperature and corresponding sublimation rate of the Cr-ball as functions of input power. In addition, an example of the total pumping speed of a gettered surface is shown. (orig.)

  16. Practical sublimation source for large-scale chromium gettering in fusion devices

    International Nuclear Information System (INIS)

    Simpkins, J.E.; Emerson, L.C.; Mioduszewski, P.K.

    1983-01-01

    This paper describes the technique of chromium gettering with a large-scale sublimation source which resembles in its design the VARIAN Ti-Ball. It consists of a hollow chromium sphere with a diameter of approximately 3 cm and an incandescent filament for radiation heating from inside the ball. While the fabrication of the source is described in a companion paper, we discuss here the gettering technique. The experimental arrangement consists of an UHV system instrumented for total- and partial-pressure measurements, a film-thickness monitor, thermocouples, an optical pyrometer, and appropriate instrumentation to measure the heating power. The results show the temperature and corresponding sublimation rate of the Cr-Ball as function of input power. In addition, an example of the total pumping speed of a gettered surface is shown

  17. Spectroscopy of lithium atoms sublimated from isolation matrix of solid Ne.

    Science.gov (United States)

    Sacramento, R L; Scudeller, L A; Lambo, R; Crivelli, P; Cesar, C L

    2011-10-07

    We have studied, via laser absorption spectroscopy, the velocity distribution of (7)Li atoms released from a solid neon matrix at cryogenic temperatures. The Li atoms are implanted into the Ne matrix by laser ablation of a solid Li precursor. A heat pulse is then applied to the sapphire substrate sublimating the matrix together with the isolated atoms at around 12 K. We find interesting differences in the velocity distribution of the released Li atoms from the model developed for our previous experiment with Cr [R. Lambo, C. C. Rodegheri, D. M. Silveira, and C. L. Cesar, Phys. Rev. A 76, 061401(R) (2007)]. This may be due to the sublimation regime, which is at much lower flux for the Li experiment than for the Cr experiment, as well as to the different collisional cross sections between those species to the Ne gas. We find a drift velocity compatible with Li being thermally sublimated at 11-13 K, while the velocity dispersion around this drift velocity is low, around 5-7 K. With a slow sublimation of the matrix we can determine the penetration depth of the laser ablated Li atoms into the Ne matrix, an important information that is not usually available in most matrix isolation spectroscopy setups. The present results with Li, together with the previous results with Cr suggest this to be a general technique for obtaining cryogenic atoms, for spectroscopic studies, as well as for trap loading. The release of the isolated atoms is also a useful tool to study and confirm details of the matrix isolated atoms which are masked or poorly understood in the solid. © 2011 American Institute of Physics

  18. New Perspectives on Blowing Snow Transport, Sublimation, and Layer Thermodynamic Structure over Antarctica

    Science.gov (United States)

    Palm, Steve; Kayetha, Vinay; Yang, Yuekui; Pauly, Rebecca M.

    2017-01-01

    Blowing snow over Antarctica is a widespread and frequent event. Satellite remote sensing using lidar has shown that blowing snow occurs over 70% of the time over large areas of Antarctica in winter. The transport and sublimation of blowing snow are important terms in the ice sheet mass balance equation and the latter is also an important part of the hydrological cycle. Until now the only way to estimate the magnitude of these processes was through model parameterization. We present a technique that uses direct satellite observations of blowing snow and model (MERRA-2) temperature and humidity fields to compute both transport and sublimation of blowing snow over Antarctica for the period 2006 to 2016. The results show a larger annual continent-wide integrated sublimation than current published estimates and a significant transport of snow from continent to ocean. The talk will also include the lidar backscatter structure of blowing snow layers that often reach heights of 200 to 300 m as well as the first dropsonde measurements of temperature, moisture and wind through blowing snow layers.

  19. Vapor pressures and sublimation enthalpies of seven heteroatomic aromatic hydrocarbons measured using the Knudsen effusion technique

    International Nuclear Information System (INIS)

    Goldfarb, Jillian L.; Suuberg, Eric M.

    2010-01-01

    The vapor pressures of seven heteroatom-containing cyclic aromatic hydrocarbons, ranging in molecular weight from (168.19 to 208.21) g . mol -1 were measured over the temperature range of (301 to 486) K using the isothermal Knudsen effusion technique. The compounds measured include: anthraquinone, 9-fluorenone, 9-fluorenone oxime, phenoxazine, phenoxathiin, and 9H-pyrido[3,4-b]indole. These solid-state sublimation measurements provided values that are compared to vapor pressures of parent aromatic compounds (anthracene and fluorene) and to others with substituent groups in order to examine the effects of alcohol, ketone, pyridine, and pyrrole functionality on this property. The enthalpies and entropies of sublimation for each compound were determined from the Clausius-Clapeyron equation. Though there is no consistent trend in terms of the effects of substitutions on changes in the enthalpy or entropy of sublimation, we note that the prevalence of enthalpic or entropic driving forces on vapor pressure depend on molecule-specific factors and not merely molecular weight of the substituents.

  20. Vapor pressures and sublimation enthalpies of seven heteroatomic aromatic hydrocarbons measured using the Knudsen effusion technique

    Energy Technology Data Exchange (ETDEWEB)

    Goldfarb, Jillian L., E-mail: JillianLGoldfarb@gmail.co [Division of Engineering, Brown University, Providence, RI 02912 (United States); Suuberg, Eric M., E-mail: Eric_Suuberg@brown.ed [Division of Engineering, Brown University, Providence, RI 02912 (United States)

    2010-06-15

    The vapor pressures of seven heteroatom-containing cyclic aromatic hydrocarbons, ranging in molecular weight from (168.19 to 208.21) g . mol{sup -1} were measured over the temperature range of (301 to 486) K using the isothermal Knudsen effusion technique. The compounds measured include: anthraquinone, 9-fluorenone, 9-fluorenone oxime, phenoxazine, phenoxathiin, and 9H-pyrido[3,4-b]indole. These solid-state sublimation measurements provided values that are compared to vapor pressures of parent aromatic compounds (anthracene and fluorene) and to others with substituent groups in order to examine the effects of alcohol, ketone, pyridine, and pyrrole functionality on this property. The enthalpies and entropies of sublimation for each compound were determined from the Clausius-Clapeyron equation. Though there is no consistent trend in terms of the effects of substitutions on changes in the enthalpy or entropy of sublimation, we note that the prevalence of enthalpic or entropic driving forces on vapor pressure depend on molecule-specific factors and not merely molecular weight of the substituents.

  1. A analítica kantiana do sublime em Friedrich Schiller

    Directory of Open Access Journals (Sweden)

    Artur Bispo dos Santos Neto

    2016-10-01

    Full Text Available O nosso texto tem como propósito apontar a articulação existente entre a estética kantiana, expressa na sua obra basilar Crítica da faculdade do juízo, e a reflexão estética constituída por Friedrich Schiller mediante a sua noção de sublime. Embora Schiller se inscreva sob o signo da influência da terceira Crítica, vamos mostrar na tessitura deste texto como consegue libertar-se da influência kantiana, ao recusar a centralidade do juízo de gosto na definição do belo e afirmar a beleza (puchritudo como liberdade no fenômeno. Schiller não se limita à investigação do sublime no âmbito da beleza livre (natureza, mas investiga-a especialmente no campo da beleza aderente. Embora o próprio Kant tenha atribuído ao gosto o significado de uma transição do prazer dos sentidos à disposição moral, será Schiller quem radicalizará o propósito de uma educação moral do homem pela mediação do sublime e do patético na arte.

  2. Application of a Kalman filter to UF6 gaseous diffusion plant freezer/sublimer systems

    International Nuclear Information System (INIS)

    Ruppel, F.R.

    1992-03-01

    A signal is required to control the flow of UF 6 in gaseous diffusion plant freezer/sublimer systems. The original strategy envisioned for deriving a flow signal was to take the derivative of the freezer/sublimer weigh cell signal. However, the derivative of the digitized weight signal is noisy, preventing good control. In addition, a bias is introduced into the weight derivative signal because a refrigerant is circulated through a shell-and-tube heat exchanger inside the freezer/sublimer. The weight of the refrigerant is included in the weight measured by the weigh cell. If the circulation rate of the refrigerent is not steady state, a bias exists. Measurements of upstream pressure, vessel pressure, and output to the system control valve are available to the control system. Thus, if the flow through the control valve is characterized properly by the measurements, a Kalman filter can be used in conjunction with these auxiliary inputs and the weigh cell input to overcome the noise and bias problem and provide an improve estimate of flow rate. A discussion of the development and the current status of a Kalman filter used for this application is given. 5 refs

  3. Simultaneous alignment and clustering of peptide data using a Gibbs sampling approach

    DEFF Research Database (Denmark)

    Andreatta, Massimo; Lund, Ole; Nielsen, Morten

    2013-01-01

    Motivation: Proteins recognizing short peptide fragments play a central role in cellular signaling. As a result of high-throughput technologies, peptide-binding protein specificities can be studied using large peptide libraries at dramatically lower cost and time. Interpretation of such large...... peptide datasets, however, is a complex task, especially when the data contain multiple receptor binding motifs, and/or the motifs are found at different locations within distinct peptides.Results: The algorithm presented in this article, based on Gibbs sampling, identifies multiple specificities...... of unaligned peptide datasets of variable length. Example applications described in this article include mixtures of binders to different MHC class I and class II alleles, distinct classes of ligands for SH3 domains and sub-specificities of the HLA-A*02:01 molecule.Availability: The Gibbs clustering method...

  4. Uniqueness of Gibbs measure for Potts model with countable set of spin values

    International Nuclear Information System (INIS)

    Ganikhodjaev, N.N.; Rozikov, U.A.

    2004-11-01

    We consider a nearest-neighbor Potts model with countable spin values 0,1,..., and non zero external field, on a Cayley tree of order k (with k+1 neighbors). We study translation-invariant 'splitting' Gibbs measures. We reduce the problem to the description of the solutions of some infinite system of equations. For any k≥1 and any fixed probability measure ν with ν(i)>0 on the set of all non negative integer numbers Φ={0,1,...} we show that the set of translation-invariant splitting Gibbs measures contains at most one point, independently on parameters of the Potts model with countable set of spin values on Cayley tree. Also we give a full description of the class of measures ν on Φ such that wit respect to each element of this class our infinite system of equations has unique solution {a i =1,2,...}, where a is an element of (0,1). (author)

  5. Inverse problems with non-trivial priors: efficient solution through sequential Gibbs sampling

    DEFF Research Database (Denmark)

    Hansen, Thomas Mejer; Cordua, Knud Skou; Mosegaard, Klaus

    2012-01-01

    Markov chain Monte Carlo methods such as the Gibbs sampler and the Metropolis algorithm can be used to sample solutions to non-linear inverse problems. In principle, these methods allow incorporation of prior information of arbitrary complexity. If an analytical closed form description of the prior...... is available, which is the case when the prior can be described by a multidimensional Gaussian distribution, such prior information can easily be considered. In reality, prior information is often more complex than can be described by the Gaussian model, and no closed form expression of the prior can be given....... We propose an algorithm, called sequential Gibbs sampling, allowing the Metropolis algorithm to efficiently incorporate complex priors into the solution of an inverse problem, also for the case where no closed form description of the prior exists. First, we lay out the theoretical background...

  6. GROTESQUE ENCOUNTERS: READING SHAKESPEARE’S THE MERCHANT OF VENICE ALONG THE PRINCIPLES OF THE SUBLIME, BEAUTIFUL AND GROTESQUE

    Directory of Open Access Journals (Sweden)

    Kathrin Bartha

    2015-12-01

    Full Text Available This article is an attempt to apply the basic principles of the aesthetic discourse on the sublime, beautiful and grotesque to William Shakespeare's The Merchant of Venice. Even though it is a discourse that only begins in the course of the eighteenth century, I will argue that the structure of the play parallels the model of the traditional sublime, as it deals with a subject-object binary and meditates on the relationship between the material (body and the transcendental (mind. However, the play is also rich in disruptive — or grotesque — forces that unsettle this binary structure. The parallels between the play and the aesthetic discourse could not only help our understanding of postmodern criticism and rewriting of the sublime, but the sublime can also, in turn, shed light on the reception of the play.

  7. Shades of Grey: The Role of the Sublime in the Memorial to the Murdered Jews of Europe

    Directory of Open Access Journals (Sweden)

    Karen Wilson Baptist

    2012-12-01

    Full Text Available As a ‘post-disaster’ landscape, the Memorial to the Murdered Jews of Europe does, arguably, occupy ground where the mass extermination of the Jewish people of Europe was masterminded, but it is not physically a site of death. Commonly, memorial landscapes are erected upon the location where violence, tragedy and disaster have occurred. Divorced from the diasporic dead it seeks to honour, the memorial employs spatial form, the surrounding atmosphere and human memory to potentialise a sublime experience for visitors. The sublime plays an essential role in memorial landscapes because sublime experiences are heightened, unforgettable and enduring. This reduces the possibility that visitors will depart the memorial unscathed, leaving the monument to bear the burden of memory. While a sublime experience can be optimised, it cannot be given, thus, the onus of remembering the Holocaust remains our responsibility.

  8. Entropy Calculation of Reversible Mixing of Ideal Gases Shows Absence of Gibbs Paradox

    Directory of Open Access Journals (Sweden)

    Oleg Borodiouk

    1999-05-01

    Full Text Available Abstract: We consider the work of reversible mixing of ideal gases using a real process. Now assumptions were made concerning infinite shifts, infinite number of cycles and infinite work to provide an accurate calculation of entropy resulting from reversible mixing of ideal gases. We derived an equation showing the dependence of this entropy on the difference in potential of mixed gases, which is evidence for the absence of Gibbs' paradox.

  9. Entropy Calculation of Reversible Mixing of Ideal Gases Shows Absence of Gibbs Paradox

    OpenAIRE

    Oleg Borodiouk; Vasili Tatarin

    1999-01-01

    Abstract: We consider the work of reversible mixing of ideal gases using a real process. Now assumptions were made concerning infinite shifts, infinite number of cycles and infinite work to provide an accurate calculation of entropy resulting from reversible mixing of ideal gases. We derived an equation showing the dependence of this entropy on the difference in potential of mixed gases, which is evidence for the absence of Gibbs' paradox.

  10. Sampling informative/complex a priori probability distributions using Gibbs sampling assisted by sequential simulation

    DEFF Research Database (Denmark)

    Hansen, Thomas Mejer; Mosegaard, Klaus; Cordua, Knud Skou

    2010-01-01

    Markov chain Monte Carlo methods such as the Gibbs sampler and the Metropolis algorithm can be used to sample the solutions to non-linear inverse problems. In principle these methods allow incorporation of arbitrarily complex a priori information, but current methods allow only relatively simple...... this algorithm with the Metropolis algorithm to obtain an efficient method for sampling posterior probability densities for nonlinear inverse problems....

  11. Gibbs paradox of entropy of mixing experimental facts. Its rejection, and the theoretical consequences

    International Nuclear Information System (INIS)

    Lin, Shu-Kun

    1996-01-01

    Gibbs paradox statement of entropy of mixing has been regarded as the theoretical foundation of statistical mechanics, quantum theory and biophysics. However, all the relevant chemical experimental observations and logical analyses indicate that the Gibbs paradox statement is false. I prove that this statement is wrong: Gibbs paradox statement implies that entropy decreases with the increase in symmetry (as represented by a symmetry number σ; see any statistical mechanics textbook). From group theory any system has at least a symmetry number σ=1 which is the identity operation for a strictly asymmetric system. It follows that the entropy of a system is equal to, or less than, zero. However, from either von Neumann-Shannon entropy formula (S(w) =-Σ ω in p 1 ) or the Boltzmann entropy formula (S = in w) and the original definition, entropy is non-negative. Therefore, this statement is false. It should not be a surprise that for the first time, many outstanding problems such as the validity of Pauling's resonance theory, the explanation of second order phase transition phenomena, the biophysical problem of protein folding and the related hydrophobic effect, etc., can be solved. Empirical principles such as Pauli principle (and Hund's rule) and HSAB principle, etc., can also be given a theoretical explanation

  12. Screening disrupted molecular functions and pathways associated with clear cell renal cell carcinoma using Gibbs sampling.

    Science.gov (United States)

    Nan, Ning; Chen, Qi; Wang, Yu; Zhai, Xu; Yang, Chuan-Ce; Cao, Bin; Chong, Tie

    2017-10-01

    To explore the disturbed molecular functions and pathways in clear cell renal cell carcinoma (ccRCC) using Gibbs sampling. Gene expression data of ccRCC samples and adjacent non-tumor renal tissues were recruited from public available database. Then, molecular functions of expression changed genes in ccRCC were classed to Gene Ontology (GO) project, and these molecular functions were converted into Markov chains. Markov chain Monte Carlo (MCMC) algorithm was implemented to perform posterior inference and identify probability distributions of molecular functions in Gibbs sampling. Differentially expressed molecular functions were selected under posterior value more than 0.95, and genes with the appeared times in differentially expressed molecular functions ≥5 were defined as pivotal genes. Functional analysis was employed to explore the pathways of pivotal genes and their strongly co-regulated genes. In this work, we obtained 396 molecular functions, and 13 of them were differentially expressed. Oxidoreductase activity showed the highest posterior value. Gene composition analysis identified 79 pivotal genes, and survival analysis indicated that these pivotal genes could be used as a strong independent predictor of poor prognosis in patients with ccRCC. Pathway analysis identified one pivotal pathway - oxidative phosphorylation. We identified the differentially expressed molecular functions and pivotal pathway in ccRCC using Gibbs sampling. The results could be considered as potential signatures for early detection and therapy of ccRCC. Copyright © 2017 Elsevier Ltd. All rights reserved.

  13. The Gibbs-Thomson equation for a spherical coherent precipitate with applications to nucleation

    International Nuclear Information System (INIS)

    Rottman, C.; Voorhees, P.W.; Johnson, W.C.

    1988-01-01

    The conditions for interfacial thermodynamic equilibrium form the basis for the derivation of a number of basic equations in materials science, including the various forms of the Gibbs-Thomson equation. The equilibrium conditions pertaining to a curved interface in a two-phase fluid system are well-known. In contrast, the conditions for thermodynamic equilibrium at a curved interface in nonhydrostatically stressed solids have only recently been examined. These conditions can be much different from those at a fluid interface and, as a result, the Gibbs-Thomson equation appropriate to coherent solids is likely to be considerably different from that for fluids. In this paper, the authors first derive the conditions necessary for thermodynamic equilibrium at the precipitate-matrix interface of a coherent spherical precipitate. The authors' derivation of these equilibrium conditions includes a correction to the equilibrium conditions of Johnson and Alexander for a spherical precipitate in an isotropic matrix. They then use these conditions to derive the dependence of the interfacial precipitate and matrix concentrations on precipitate radius (Gibbs-Thomson equation) for a such a precipitate. In addition, these relationships are then used to calculate the critical radius for the nucleation of a coherent misfitting precipitate

  14. Additive scheme for calculation of solvation enthalpies of heterocyclic aromatic compounds. Sublimation/vaporization enthalpy at 298.15 K

    International Nuclear Information System (INIS)

    Solomonov, Boris N.; Nagrimanov, Ruslan N.; Mukhametzyanov, Timur A.

    2016-01-01

    Highlights: • Additivity scheme for solvation enthalpies estimation of heteroaromatic compounds was proposed. • Method for determination of vaporization/sublimation enthalpies directly at 298.15 K was developed. • Solution enthalpies of 25 heteroaromatic compounds were measured. • Vaporization/sublimation enthalpies of 44 heteroaromatic compounds were determined. • Obtained values are in good agreement with the results of conventional methods. - Abstract: Hereby we propose a method for determination of vaporization and sublimation enthalpies of heterocyclic and carbonyl-containing aromatic compounds at 298.15 K. According to this method vaporization and sublimation enthalpies at 298.15 K are determined based on enthalpies of solvation and solution. Solvation enthalpies of heteroatomatic and carbonyl-containing compounds are calculated using an additive scheme from the solvation enthalpy of closest aromatic hydrocarbon and contributions related to the exchange of CH-groups of hydrocarbon with corresponding substituent atoms or groups. Measured solution enthalpies together with calculated solvation enthalpies allowed to calculate corresponding vaporization and sublimation enthalpies at 298.15 K for a large number of heterocyclic and carbonyl-containing compounds. We have also found that in a number of cases instead of solution enthalpy in benzene at 298.15 K fusion enthalpy at the melting temperature can be used. Comparison between literature data and calculated vaporization and sublimation enthalpies demonstrates satisfactory performance of the proposed method.

  15. Additive scheme for calculation of solvation enthalpies of heterocyclic aromatic compounds. Sublimation/vaporization enthalpy at 298.15 K

    Energy Technology Data Exchange (ETDEWEB)

    Solomonov, Boris N., E-mail: boris.solomonov@kpfu.ru; Nagrimanov, Ruslan N.; Mukhametzyanov, Timur A.

    2016-06-10

    Highlights: • Additivity scheme for solvation enthalpies estimation of heteroaromatic compounds was proposed. • Method for determination of vaporization/sublimation enthalpies directly at 298.15 K was developed. • Solution enthalpies of 25 heteroaromatic compounds were measured. • Vaporization/sublimation enthalpies of 44 heteroaromatic compounds were determined. • Obtained values are in good agreement with the results of conventional methods. - Abstract: Hereby we propose a method for determination of vaporization and sublimation enthalpies of heterocyclic and carbonyl-containing aromatic compounds at 298.15 K. According to this method vaporization and sublimation enthalpies at 298.15 K are determined based on enthalpies of solvation and solution. Solvation enthalpies of heteroatomatic and carbonyl-containing compounds are calculated using an additive scheme from the solvation enthalpy of closest aromatic hydrocarbon and contributions related to the exchange of CH-groups of hydrocarbon with corresponding substituent atoms or groups. Measured solution enthalpies together with calculated solvation enthalpies allowed to calculate corresponding vaporization and sublimation enthalpies at 298.15 K for a large number of heterocyclic and carbonyl-containing compounds. We have also found that in a number of cases instead of solution enthalpy in benzene at 298.15 K fusion enthalpy at the melting temperature can be used. Comparison between literature data and calculated vaporization and sublimation enthalpies demonstrates satisfactory performance of the proposed method.

  16. Time Variability of the Dust Sublimation Zones in Pre-Main Sequence Disk Systems

    Science.gov (United States)

    Sitko, Michael L.; Carpenter, W. J.; Grady, C. A.; Russel, R. W.; Lynch, D. K.; Rudy, R. J.; Mazuk, S. M.; Venturini, C. C.; Kimes, R. L.; Beerman, L. C.; hide

    2007-01-01

    The dust sublimation zone (DSZ) is the region of pre-main sequence (PMS) disks where dust grains most easily anneal, sublime, and condense out of the gas. Because of this, it is a location where crystalline material may be enhanced and redistributed throughout the rest of the disk. A decade-long program to monitor the thermal emission of the grains located in this region demonstrates that large changes in emitted flux occur in many systems. Changes in the thermal emission between 3 and 13.5 microns were observed in HD 31648 (MWC 480), HD 163296 (MWC 275), and DG Tau. This emission is consistent with it being produced at the DSZ, where the transition from a disk of gas to one of gas+dust occurs. In the case of DG Tau, the outbursts were accompanied by increased emission on the 10 micron silicate band on one occasion, while on another occasion it went into absorption. This requires lofting of the material above the disk into the line of sight. Such changes will affect the determination of the inner disk structure obtained through interferometry measurements, and this has been confirmed in the case of HD 163296. Cyclic variations in the heating of the DSZ will lead to the annealing of large grains, the sublimation of smaller grains, possibly followed by re-condensation as the zone enters a cooling phase. Lofting of dust above the disk plane, and outward acceleration by stellar winds and radiation pressure, can re-distribute the processed material to cooler regions of the disk, where cometesimals form. This processing is consistent with the detection of the preferential concentration of large crystalline grains in the inner few AU of PMS disks using interferometric spectroscopy with the VLTI.

  17. Origin and effective reduction of inversion domains in aluminum nitride grown by a sublimation method

    Science.gov (United States)

    Shigetoh, Keisuke; Horibuchi, Kayo; Nakamura, Daisuke

    2017-11-01

    Owing to the large differences in the chemical properties between Al and N polarities in aluminum nitride (AlN), the choice of the polar direction for crystal growth strongly affects not only the quality but also the shape (facet formation) of the grown crystal. In particular, N-polar (0 0 0 -1) has been considered to be a more preferable direction than Al-polar (0 0 0 1) for sublimation growth because compared to Al-polar (0 0 0 1), N-polar (0 0 0 -1) exhibits better stability at high growth rate (high supersaturation) conditions and enables easier lateral enlargement of the crystal. However, some critical growth conditions induce polarity inversion and hinder stable N-polar growth. Furthermore, the origin of the polarity inversion in AlN growth by the sublimation method is still unclear. To ensure stable N-polar growth without polarity inversion, the formation mechanism of the inversion domain during AlN sublimation growth must be elucidated. Therefore, herein, we demonstrate homoepitaxial growth on an N-polar seed and carefully investigate the obtained crystal that shows polarity inversion. Annular bright-field scanning transmission electron microscopy reveals that polarity is completely converted to the Al polarity via the formation of a 30 nm thick mixed polar layer (MPL) just above the seed. Moreover, three-dimensional atom probe tomography shows the segregation of the oxygen impurities in the MPL with a high concentration of about 3 atom%. Finally, by avoiding the incorporation of oxygen impurity into the crystal at the initial stage of the growth, we demonstrate an effective reduction (seven orders of magnitude) of the inversion domain boundary formation.

  18. Wasting the Future: The Technological Sublime, Communications Technologies, and E-waste

    Directory of Open Access Journals (Sweden)

    Sebine Label

    2012-08-01

    Full Text Available Literally speaking, e-waste is the future of communications. E-waste is the fastest growing waste stream in the world, much of it communications technologies from cell phones to laptops, televisions to peripherals. As a result of policies of planned obsolescence working computers, cell phones, and tablets are routinely trashed. One of the most powerful and enduring discourses associated with emerging technologies is the technological sublime, in which technology is seen as intellectually, emotionally, or spiritually transcendent. It comprises a contradictory impulse that elevates technology with an almost religious fervor, while simultaneously overlooking some of the consequences of industrialism, as well as ignoring the necessity of social, economic, and governmental infrastructures necessary to the implementation and development of new technologies. The idea that a new technology will not pollute or harm the environment is a persistent, though often quickly passed over, theme in the technological sublime, echoed in discourses about emerging technologies such as the silicon chip, the internet, and other ICTs. In this paper, I make connections between the discourse of newness, the practice of planned obsolescence, and the mountains of trashed components and devices globally. Considering the global context demonstrates the realities of the penetration of ICTs and their enduring pollution and negative implications for the health of humans and nonhumans, including plants, animals, waterways, soil, air and so on. I use the discourse of the technological sublime to open up and consider the future of communications, to argue that this discourse not only stays with us but also contains within it two important and related components, the promise of ecological harmony and a future orientation. I argue that these lingering elements keep us from considering the real future of communications – e-waste – and that, as communications scholars, we must also

  19. Measuring Enthalpy of Sublimation of Volatiles by Means of Piezoelectric Crystal Microbalances

    Science.gov (United States)

    Dirri, Fabrizio; Palomba, Ernesto; Longobardo, Andrea; Zampetti, Emiliano

    2017-12-01

    Piezoelectric Crystal Microbalances (PCM's) are widely used to study the chemical processes involving volatile compounds in any environment, such as condensation process. Since PCM's are miniaturized sensor, they are very suitable for planetary in situ missions, where can be used to detect and to measure the mass amount of astrobiologically significant compounds, such as water and organics. This work focuses on the realization and testing of a new experimental setup, able to characterize volatiles which can be found in a planetary environment. In particular the enthalpy of sublimation of some dicarboxylic acids has been measured. The importance of dicarboxylic acids in planetology and astrobiology is due to the fact that they have been detected in carbonaceous chondritic material (e.g. Murchinson), among the most pristine material present in our Solar System. In this work, a sample of acid was heated in an effusion cell up to its sublimation. For a set of temperatures (from 30 °C to 75 °C), the deposition rate on the PCM surface has been measured. From these measurements, it has been possible to infer the enthalpy of sublimation of Adipic acid, i.e. ΔH = 141.6 ± 0.8 kJ/mol and Succinic acid, i.e. ΔH = 113.3 ± 1.3 kJ/mol. This technique has so demonstrated to be a good choice to recognise a single compound or a mixture (with an analysis upstream) even if some improvements concerning the thermal stabilization of the system will be implemented in order to enhance the results' accuracy. The experiment has been performed in support of the VISTA (Volatile In Situ Thermogravimetry Analyzer) project, which is included in the scientific payload of the ESA MarcoPolo-R mission study.

  20. Piezoelectric crystal microbalance measurements of enthalpy of sublimation of C2-C9 dicarboxylic acids

    Science.gov (United States)

    Dirri, F.; Palomba, E.; Longobardo, A.; Zampetti, E.

    2016-02-01

    We present here a novel experimental set-up that is able to measure the enthalpy of sublimation of a given compound by means of piezoelectric crystal microbalances (PCMs). The PCM sensors have already been used for space measurements, such as for the detection of organic and non-organic volatile species and refractory materials in planetary environments. In Earth atmospherics applications, PCMs can be also used to obtain some physical-chemical processes concerning the volatile organic compounds (VOCs) present in atmospheric environments. The experimental set-up has been developed and tested on dicarboxylic acids. In this work, a temperature-controlled effusion cell was used to sublimate VOC, creating a molecular flux that was collimated onto a cold PCM. The VOC recondensed onto the PCM quartz crystal, allowing the determination of the deposition rate. From the measurements of deposition rates, it has been possible to infer the enthalpy of sublimation of adipic acid, i.e. ΔHsub : 141.6 ± 0.8 kJ mol-1, succinic acid, i.e. 113.3 ± 1.3 kJ mol-1, oxalic acid, i.e. 62.5 ± 3.1 kJ mol-1, and azelaic acid, i.e. 124.2 ± 1.2 kJ mol-1. The results obtained show an accuracy of 1 % for succinic, adipic, and azelaic acid and within 5 % for oxalic acid and are in very good agreement with previous works (within 6 % for adipic, succinic, and oxalic acid and within 11 % or larger for azelaic acid).

  1. Thick epitaxial CdTe films grown by close space sublimation on Ge substrates

    Energy Technology Data Exchange (ETDEWEB)

    Jiang, Q; Haliday, D P; Tanner, B K; Brinkman, A W [Department of Physics, University of Durham. Science Site, Durham, DH1 3LE (United Kingdom); Cantwell, B J; Mullins, J T; Basu, A [Durham Scientific Crystals Ltd., NetPark, Thomas Wright Way, Sedgefield, County Durham, TS21 3FD (United Kingdom)], E-mail: Q.Z.Jiang@durham.ac.uk

    2009-01-07

    This paper reports, for the first time, the successful growth of 200 {mu}m thick CdTe films on mis-oriented Ge(1 0 0) substrates by a cost-effective optimized close space sublimation method. It is found that, as the thickness increases to a few hundred micrometres, subgrains are formed probably as a result of the large density of dislocations and strain within the initial interfacial layers. The films are of high quality (x-ray rocking curve width {approx}100 arcsec) and high resistance ({approx}10{sup 9} {omega} cm), and are thus candidates for x-ray and {gamma}-ray detectors. (fast track communication)

  2. Low-level precipitation sublimation on the coasts of East Antarctica

    Science.gov (United States)

    Grazioli, Jacopo; Genthon, Christophe; Madeleine, Jean-Baptiste; Lemonnier, Florentin; Gallée, Hubert; Krinner, Gerhard; Berne, Alexis

    2017-04-01

    The weather of East Antarctica is affected by the peculiar morphology of this large continent and by its isolation from the surroundings. The high-elevation interior of the continent, very dry in absolute terms, originates winds that can reach the coastal areas with very high speed and persistence in time. The absence of topographic barriers and the near-ground temperature inversion allow these density-driven air movements to fall from the continent towards the coasts without excessive interaction and mixing with the atmosphere aloft. Thus, the air remains dry in absolute terms, and very dry in relative terms because of the higher temperatures near the coast and the adiabatic warming due to the descent. The coasts of Antarctica are less isolated and more exposed to incoming moist air masses than the rest of the continent, and precipitation in the form of snowfall more frequently occurs. Through its descent, however, snowfall encounters the layer of dry air coming from the continent and the deficit in humidity can lead to the partial or complete sublimation of the precipitating flux. This phenomenon is named here LPS (Low-level Precipitation Sublimation) and it has been observed by means of ground-based remote sensing instruments (weather radars) and atmospheric radio-sounding balloons records in the framework of the APRES3 campaign (Antarctic Precipitation: REmote Sensing from Surface and Space) in the coastal base of Dumont d' Urville (Terre Adélie), and then examined at the continental scale thanks to numerical weather models. LPS occurs over most of the coastal locations, where the total sublimated snowfall can be a significant percentage of the total snowfall. For example, in Dumont d' Urville the total yearly snowfall at 341 m height is less than 80% of the snowfall at 941 m height (the height of maximum yearly accumulation), and at shorter time scales complete sublimation (i.e. virga) often occurs. At the scale of individual precipitation events, LPS is

  3. Induced Recrystallization of CdTe Thin Films Deposited by Close-Spaced Sublimation

    International Nuclear Information System (INIS)

    Mayo, B.

    1998-01-01

    We have deposited CdTe thin films by close-spaced sublimation at two different temperature ranges. The films deposited at the lower temperature partially recrystallized after CdCl2 treatment at 350C and completely recrystallized after the same treatment at 400C. The films deposited at higher temperature did not recrystallize at these two temperatures. These results confirmed that the mechanisms responsible for changes in physical properties of CdTe films treated with CdCl2 are recrystallization and grain growth, and provided an alternative method to deposit CSS films using lower temperatures

  4. Prediction of enthalpy and standard Gibbs energy of vaporization of haloaromatics from atomic properties.

    Science.gov (United States)

    Monte, M J S; Almeida, A R R P; Liebman, J F

    2015-11-01

    Halogenated benzenes form a class of pollutants with a huge number of members - 1504 distinct benzene compounds, where one or more hydrogen atoms are replaced by halogens, may exist theoretically. This study presents a user friendly method for accurate prediction of vapor pressures and enthalpies of vaporization, at 298.15 K, of any mono or poly halobenzene compound. The derived equations for the prediction of those vaporization properties depend just on the number of each constituent halogen atom. This is a consequence of the absence of intramolecular interactions between the halogen atoms, revealed after examining vaporization results of ca. 40 halogenated benzenes. In order to rationalize the estimation equations, the contribution of the halogen atoms for the referred to above properties of vaporization was decomposed into two atomic properties - the volume and electron affinity. Extension of the applicability of the estimation method to substituted benzenes containing other substituent groups beyond halogen atoms as well as to some polycyclic aromatic species was tested with success. Copyright © 2015 Elsevier Ltd. All rights reserved.

  5. Teaching the Concept of Gibbs Energy Minimization through Its Application to Phase-Equilibrium Calculation

    Science.gov (United States)

    Privat, Romain; Jaubert, Jean-Noe¨l; Berger, Etienne; Coniglio, Lucie; Lemaitre, Ce´cile; Meimaroglou, Dimitrios; Warth, Vale´rie

    2016-01-01

    Robust and fast methods for chemical or multiphase equilibrium calculation are routinely needed by chemical-process engineers working on sizing or simulation aspects. Yet, while industrial applications essentially require calculation tools capable of discriminating between stable and nonstable states and converging to nontrivial solutions,…

  6. Zoeal morphology of Pachygrapsus transversus (Gibbes (Decapoda, Grapsidae reared in the laboratory

    Directory of Open Access Journals (Sweden)

    Ana Luiza Brossi-Garcia

    1997-12-01

    Full Text Available Ovigerous females of Pachygrapsus transversus (Gibbes, 1850 were collected on the Praia Dura and Saco da Ribeira beaches, Ubatuba, São Paulo, Brazil. Larvae were individually reared in a climatic room at 25ºC temperature, salinities of 28, 32 and 35‰ and under natural photoperiod conditions. The best rearing results were observed at 35%o salinity. Seven zoeal instars were observed, drawing and described in detail. The data are compared with those obtained for P. gracilis (Saussure, 1858.

  7. ASTEM, Evaluation of Gibbs, Helmholtz and Saturation Line Function for Thermodynamics Calculation

    International Nuclear Information System (INIS)

    Moore, K.V.; Burgess, M.P.; Fuller, G.L.; Kaiser, A.H.; Jaeger, D.L.

    1974-01-01

    1 - Description of problem or function: ASTEM is a modular set of FORTRAN IV subroutines to evaluate the Gibbs, Helmholtz, and saturation line functions as published by the American Society of Mechanical Engineers (1967). Any thermodynamic quantity including derivative properties can be obtained from these routines by a user-supplied main program. PROPS is an auxiliary routine available for the IBM360 version which makes it easier to apply the ASTEM routines to power station models. 2 - Restrictions on the complexity of the problem: Unless re-dimensioned by the user, the highest derivative allowed is order 9. All arrays within ASTEM are one-dimensional to save storage area

  8. LA CASA GIBBS Y EL MONOPOLIO SALITRERO PERUANO: 1876-1878

    Directory of Open Access Journals (Sweden)

    Manuel Ravest Mora

    2008-06-01

    Full Text Available El objeto de este breve trabajo es mostrar la disposición de Anthony Gibbs & Sons, y de sus filiales, a apoyar el proyecto monopólico salitrero del Perú con recursos monetarios y los manejos de sus directores en la única empresa que, dada su capacidad de elaboración, podía hacerlo fracasar: la Compañía de Salitres y Ferrocarril de Antofagasta, de la que Gibbs era el segundo mayor accionista. Para el gobierno chileno la causa primaria de la guerra de 1879 fue el intento del Perú por monopolizar la producción salitrera. Bolivia, su aliada secreta desde 1873, colaboró arrendándole y vendiéndole sus depósitos de nitrato, e imponiendo a la exportación del salitre un tributo que infringió la condición -estipulada en un Tratado de Límites- bajo la cual Chile le cedió territorio. Su recuperación manu militari inició el conflicto. A partir de la segunda mitad del siglo pasado esta tesis economicista-legalista fue cuestionada en Chile y en el exterior, desplazando el acento causal al reordenamiento de los mercados de materias primas -de las que los beligerantes eran exportadores- a consecuencia de la crisis mundial de la década de 1870.This brief study aims at showing Anthony Gibbs & Sons disposition in supporting the Peruvian monopolistic nitrate project with monetary resources and its Director's influences in the only company which, due its production's capacity, could make the project fail: the Chilean Antofagasta Nitrate and Railway Co. in which Gibbs was the second most important stockholder. According to Chilean government the primary cause of 1879's war was Peru's attempt to monopolize nitrate production. Bolivia, its secret allied since 1873, helped renting and selling him her nitrate fields and imposing a tax on the nitrate exports of the Chilean company in Antofagasta, thus violating the condition stated in a Border Treaty by which Chile had ceded territory. Its recovery through the use of military forcé was the first act

  9. Simulation of wind-induced snow transport and sublimation in alpine terrain using a fully coupled snowpack/atmosphere model

    Science.gov (United States)

    Vionnet, V.; Martin, E.; Masson, V.; Guyomarc'h, G.; Naaim-Bouvet, F.; Prokop, A.; Durand, Y.; Lac, C.

    2014-03-01

    In alpine regions, wind-induced snow transport strongly influences the spatio-temporal evolution of the snow cover throughout the winter season. To gain understanding on the complex processes that drive the redistribution of snow, a new numerical model is developed. It directly couples the detailed snowpack model Crocus with the atmospheric model Meso-NH. Meso-NH/Crocus simulates snow transport in saltation and in turbulent suspension and includes the sublimation of suspended snow particles. The coupled model is evaluated against data collected around the experimental site of Col du Lac Blanc (2720 m a.s.l., French Alps). First, 1-D simulations show that a detailed representation of the first metres of the atmosphere is required to reproduce strong gradients of blowing snow concentration and compute mass exchange between the snowpack and the atmosphere. Secondly, 3-D simulations of a blowing snow event without concurrent snowfall have been carried out. Results show that the model captures the main structures of atmospheric flow in alpine terrain. However, at 50 m grid spacing, the model reproduces only the patterns of snow erosion and deposition at the ridge scale and misses smaller scale patterns observed by terrestrial laser scanning. When activated, the sublimation of suspended snow particles causes a reduction of deposited snow mass of 5.3% over the calculation domain. Total sublimation (surface + blowing snow) is three times higher than surface sublimation in a simulation neglecting blowing snow sublimation.

  10. An investigation on the mechanism of sublimed DHB matrix on molecular ion yields in SIMS imaging of brain tissue.

    Science.gov (United States)

    Dowlatshahi Pour, Masoumeh; Malmberg, Per; Ewing, Andrew

    2016-05-01

    We have characterized the use of sublimation to deposit matrix-assisted laser desorption/ionization (MALDI) matrices in secondary ion mass spectrometry (SIMS) analysis, i.e. matrix-enhanced SIMS (ME-SIMS), a common surface modification method to enhance sensitivity for larger molecules and to increase the production of intact molecular ions. We use sublimation to apply a thin layer of a conventional MALDI matrix, 2,5-dihydroxybenzoic acid (DHB), onto rat brain cerebellum tissue to show how this technique can be used to enhance molecular yields in SIMS while still retaining a lateral resolution around 2 μm and also to investigate the mechanism of this enhancement. The results here illustrate that cholesterol, which is a dominant lipid species in the brain, is decreased on the tissue surface after deposition of matrix, particularly in white matter. The decrease of cholesterol is followed by an increased ion yield of several other lipid species. Depth profiling of the sublimed rat brain reveals that the lipid species are de facto extracted by the DHB matrix and concentrated in the top most layers of the sublimed matrix. This extraction/concentration of lipids directly leads to an increase of higher mass lipid ion yield. It is also possible that the decrease of cholesterol decreases the potential suppression of ion yield caused by cholesterol migration to the tissue surface. This result provides us with significant insights into the possible mechanisms involved when using sublimation to deposit this matrix in ME-SIMS.

  11. Sublimator Driven Coldplate Engineering Development Unit Test Results and Development of Second Generation SDC

    Science.gov (United States)

    Stephan, Ryan A.; Sheth, Rubik B.

    2009-01-01

    The Sublimator Driven Coldplate (SDC) is a unique piece of thermal control hardware that has several advantages over a traditional thermal control scheme. The principal advantage is the possible elimination of a pumped fluid loop, potentially increasing reliability and reducing complexity while saving both mass and power. Furthermore, the Integrated Sublimator Driven Coldplate (ISDC) concept couples a coolant loop with the previously described SDC hardware. This combination allows the SDC to be used as a traditional coldplate during long mission phases. The previously developed SDC technology cannot be used for long mission phases due to the fact that it requires a consumable feedwater for heat rejection. Adding a coolant loop also provides for dissimilar redundancy on the Altair Lander ascent module thermal control system, which is the target application for this technology. Tests were performed on an Engineering Development Unit at NASA s Johnson Space Center to quantify and assess the performance of the SDC. Correlated thermal math models were developed to help explain the test data. The paper also outlines the preliminary results of an ISDC concept being developed.

  12. Experimental and molecular dynamics simulation study of the sublimation energetics of cyclopentadienyltricarbonylmanganese (Cymantrene).

    Science.gov (United States)

    Picciochi, Ricardo; Canongia Lopes, José N; Diogo, Hermínio P; Minas da Piedade, Manuel E

    2008-10-16

    The standard molar enthalpy of sublimation of monoclinic cyclopentadienyltricarbonylmanganese, Mn(eta (5)-C 5H 5)(CO) 3, at 298.15 K, was determined as Delta sub H m (o)[Mn(eta (5)-C 5H 5)(CO) 3] = 75.97 +/- 0.37 kJ x mol (-1) from Knudsen effusion and Calvet-drop microcalorimetry measurements, thus considerably improving the very large inaccuracy (>10 kJ x mol (-1)) of the published data. The obtained value was used to assess the extension of the OPLS-based all-atom force field we previously developed for iron metallocenes to manganese organometallic compounds. The modified force field was able to reproduce the volumetric properties (density and unit-cell volume) of crystalline Mn(eta (5)-C 5H 5)(CO) 3 with a deviation of 0.6% and the experimentally determined enthalpy of sublimation with an accuracy of 1 kJ x mol (-1). The interaction (epsilon) and atomic-diameter (sigma) parameters of the Lennard-Jones (12-6) potential function used to calculate dispersion contributions within the framework of the force field were found to be transferable from iron to manganese.

  13. Verdad sublime y madre asesina en Christine V., versión de Marguerite Duras

    Directory of Open Access Journals (Sweden)

    Juliana González Holguín

    2016-01-01

    Full Text Available Todo relato es ficción, versión y, así mismo, verdad, bajo una u otra concepción de la misma, es decir, desde una perspectiva que se enfoca según la intención y la subjetividad de uno o más actores, de uno o más narradores. El texto de Marguerite Duras intitulado Sublime forcément sublime Christine V. involucra, por su contenido y su contexto, varias versiones que contrastan y se interrogan entre sí. La escritora se posiciona de tal manera que, a través de recursos propios del oficio literario, desentraña una verdad que puede no ajustarse a la realidad o al saber, pero que nos enfrenta a los límites de lo pulsional y lo ominoso.

  14. Formulation and evaluation of fast dissolving tablets of cinnarizine using superdisintegrant blends and subliming material

    Directory of Open Access Journals (Sweden)

    Biswajit Basu

    2011-01-01

    Full Text Available The aim of this investigation was to develop fast dissolving tablet of cinnarizine. A combination of super disintegrants, i.e., sodium starch glycolate (SSG and crosscarmellose sodium (CCS were used along with camphor as a subliming material. An optimized concentration of camphor was added to aid the porosity of the tablet. A 3 2 full factorial design was applied to investigate the combined effect of two formulation variables: Amount of SSG and CCS. Infrared (IR spectroscopy was performed to identify the physicochemical interaction between drug and polymer. IR spectroscopy showed that there is no interaction of drug with polymer. In the present study, direct compression was used to prepare the tablets. The powder mixtures were compressed into tablet using flat face multi punch tablet machine. Camphor was sublimed from the tablet by exposing the tablet to vacuum drier at 60°C for 12 hours. All the formulations were evaluated for their characteristics such as average weight, hardness, wetting time, friability, content uniformity, dispersion time (DT, and dissolution rate. An optimized tablet formulation (F 9 was found to have good hardness of 3.30 ± 0.10 kg/cm 2 , wetting time of 42.33 ± 4.04 seconds, DT of 34.67 ± 1.53 seconds, and cumulative drug release of not less than 99% in 16 minutes.

  15. Monte Carlo Molecular Simulation with Isobaric-Isothermal and Gibbs-NPT Ensembles

    KAUST Repository

    Du, Shouhong

    2012-01-01

    This thesis presents Monte Carlo methods for simulations of phase behaviors of Lennard-Jones fluids. The isobaric-isothermal (NPT) ensemble and Gibbs-NPT ensemble are introduced in detail. NPT ensemble is employed to determine the phase diagram of pure component. The reduced simulation results are verified by comparison with the equation of state by by Johnson et al. and results with L-J parameters of methane agree considerably with the experiment measurements. We adopt the blocking method for variance estimation and error analysis of the simulation results. The relationship between variance and number of Monte Carlo cycles, error propagation and Random Number Generator performance are also investigated. We review the Gibbs-NPT ensemble employed for phase equilibrium of binary mixture. The phase equilibrium is achieved by performing three types of trial move: particle displacement, volume rearrangement and particle transfer. The simulation models and the simulation details are introduced. The simulation results of phase coexistence for methane and ethane are reported with comparison of the experimental data. Good agreement is found for a wide range of pressures. The contribution of this thesis work lies in the study of the error analysis with respect to the Monte Carlo cycles and number of particles in some interesting aspects.

  16. Gibbs Measures Over Locally Tree-Like Graphs and Percolative Entropy Over Infinite Regular Trees

    Science.gov (United States)

    Austin, Tim; Podder, Moumanti

    2018-03-01

    Consider a statistical physical model on the d-regular infinite tree Td described by a set of interactions Φ . Let Gn be a sequence of finite graphs with vertex sets V_n that locally converge to Td. From Φ one can construct a sequence of corresponding models on the graphs G_n. Let μ_n be the resulting Gibbs measures. Here we assume that μ n converges to some limiting Gibbs measure μ on Td in the local weak^* sense, and study the consequences of this convergence for the specific entropies |V_n|^{-1}H(μ _n). We show that the limit supremum of |V_n|^{-1}H(μ _n) is bounded above by the percolative entropy H_{it{perc}}(μ ), a function of μ itself, and that |V_n|^{-1}H(μ _n) actually converges to H_{it{perc}}(μ ) in case Φ exhibits strong spatial mixing on T_d. When it is known to exist, the limit of |V_n|^{-1}H(μ _n) is most commonly shown to be given by the Bethe ansatz. Percolative entropy gives a different formula, and we do not know how to connect it to the Bethe ansatz directly. We discuss a few examples of well-known models for which the latter result holds in the high temperature regime.

  17. Monte Carlo Molecular Simulation with Isobaric-Isothermal and Gibbs-NPT Ensembles

    KAUST Repository

    Du, Shouhong

    2012-05-01

    This thesis presents Monte Carlo methods for simulations of phase behaviors of Lennard-Jones fluids. The isobaric-isothermal (NPT) ensemble and Gibbs-NPT ensemble are introduced in detail. NPT ensemble is employed to determine the phase diagram of pure component. The reduced simulation results are verified by comparison with the equation of state by by Johnson et al. and results with L-J parameters of methane agree considerably with the experiment measurements. We adopt the blocking method for variance estimation and error analysis of the simulation results. The relationship between variance and number of Monte Carlo cycles, error propagation and Random Number Generator performance are also investigated. We review the Gibbs-NPT ensemble employed for phase equilibrium of binary mixture. The phase equilibrium is achieved by performing three types of trial move: particle displacement, volume rearrangement and particle transfer. The simulation models and the simulation details are introduced. The simulation results of phase coexistence for methane and ethane are reported with comparison of the experimental data. Good agreement is found for a wide range of pressures. The contribution of this thesis work lies in the study of the error analysis with respect to the Monte Carlo cycles and number of particles in some interesting aspects.

  18. A Bayesian approach to PET reconstruction using image-modeling Gibbs priors: Implementation and comparison

    International Nuclear Information System (INIS)

    Chan, M.T.; Herman, G.T.; Levitan, E.

    1996-01-01

    We demonstrate that (i) classical methods of image reconstruction from projections can be improved upon by considering the output of such a method as a distorted version of the original image and applying a Bayesian approach to estimate from it the original image (based on a model of distortion and on a Gibbs distribution as the prior) and (ii) by selecting an open-quotes image-modelingclose quotes prior distribution (i.e., one which is such that it is likely that a random sample from it shares important characteristics of the images of the application area) one can improve over another Gibbs prior formulated using only pairwise interactions. We illustrate our approach using simulated Positron Emission Tomography (PET) data from realistic brain phantoms. Since algorithm performance ultimately depends on the diagnostic task being performed. we examine a number of different medically relevant figures of merit to give a fair comparison. Based on a training-and-testing evaluation strategy, we demonstrate that statistically significant improvements can be obtained using the proposed approach

  19. Influence of Wilbraham-Gibbs Phenomenon on Digital Stochastic Measurement of EEG Signal Over an Interval

    Directory of Open Access Journals (Sweden)

    Sovilj P.

    2014-10-01

    Full Text Available Measurement methods, based on the approach named Digital Stochastic Measurement, have been introduced, and several prototype and small-series commercial instruments have been developed based on these methods. These methods have been mostly investigated for various types of stationary signals, but also for non-stationary signals. This paper presents, analyzes and discusses digital stochastic measurement of electroencephalography (EEG signal in the time domain, emphasizing the problem of influence of the Wilbraham-Gibbs phenomenon. The increase of measurement error, related to the Wilbraham-Gibbs phenomenon, is found. If the EEG signal is measured and measurement interval is 20 ms wide, the average maximal error relative to the range of input signal is 16.84 %. If the measurement interval is extended to 2s, the average maximal error relative to the range of input signal is significantly lowered - down to 1.37 %. Absolute errors are compared with the error limit recommended by Organisation Internationale de Métrologie Légale (OIML and with the quantization steps of the advanced EEG instruments with 24-bit A/D conversion

  20. Combining the AFLOW GIBBS and elastic libraries to efficiently and robustly screen thermomechanical properties of solids

    Science.gov (United States)

    Toher, Cormac; Oses, Corey; Plata, Jose J.; Hicks, David; Rose, Frisco; Levy, Ohad; de Jong, Maarten; Asta, Mark; Fornari, Marco; Buongiorno Nardelli, Marco; Curtarolo, Stefano

    2017-06-01

    Thorough characterization of the thermomechanical properties of materials requires difficult and time-consuming experiments. This severely limits the availability of data and is one of the main obstacles for the development of effective accelerated materials design strategies. The rapid screening of new potential materials requires highly integrated, sophisticated, and robust computational approaches. We tackled the challenge by developing an automated, integrated workflow with robust error-correction within the AFLOW framework which combines the newly developed "Automatic Elasticity Library" with the previously implemented GIBBS method. The first extracts the mechanical properties from automatic self-consistent stress-strain calculations, while the latter employs those mechanical properties to evaluate the thermodynamics within the Debye model. This new thermoelastic workflow is benchmarked against a set of 74 experimentally characterized systems to pinpoint a robust computational methodology for the evaluation of bulk and shear moduli, Poisson ratios, Debye temperatures, Grüneisen parameters, and thermal conductivities of a wide variety of materials. The effect of different choices of equations of state and exchange-correlation functionals is examined and the optimum combination of properties for the Leibfried-Schlömann prediction of thermal conductivity is identified, leading to improved agreement with experimental results than the GIBBS-only approach. The framework has been applied to the AFLOW.org data repositories to compute the thermoelastic properties of over 3500 unique materials. The results are now available online by using an expanded version of the REST-API described in the Appendix.

  1. Enthalpies of fusion and enthalpies of solvation of aromatic hydrocarbons derivatives: Estimation of sublimation enthalpies at 298.15 K

    Energy Technology Data Exchange (ETDEWEB)

    Solomonov, Boris N., E-mail: boris.solomonov@kpfu.ru; Nagrimanov, Ruslan N.; Varfolomeev, Mikhail A.; Buzyurov, Aleksey V.; Mukhametzyanov, Timur A.

    2016-03-20

    Graphical abstract: - Highlights: • Solution enthalpies of aromatic hydrocarbons derivatives (ArHD) were measured at 298.15 K. • Solution enthalpies of ArHD in benzene at 298.15 K are equal to their fusion enthalpy at melting point. • Sublimation enthalpies of 80 ArHD were calculated as a sum of fusion and solvation enthalpies. • Obtained sublimation enthalpies are in good agreement with the recommended literature data. - Abstract: Enthalpy of sublimation of solid compound can be found using the values of solution enthalpy and solvation enthalpy in any solvent. In this work enthalpies of solution at infinite dilution of a number of aromatic hydrocarbons derivatives in benzene were measured at 298.15 K. Comparison between experimental and literature solution enthalpies in benzene at 298.15 K and fusion enthalpies at melting temperature of aromatic hydrocarbon derivatives showed, that these values are approximately equal. Thereby, fusion enthalpies at melting temperature can be used instead of their solution enthalpies in benzene at 298.15 K for calculation of sublimation enthalpies at 298.15 K. Solvation enthalpies in benzene at 298.15 K required for this procedure were calculated using group additivity scheme. The sublimation enthalpies of 80 aromatic hydrocarbons derivatives at 298.15 K were evaluated as a difference between fusion enthalpies at melting temperature and solvation enthalpies in benzene at 298.15 K. Obtained in this work values of sublimation enthalpy at 298.15 K for studied compounds were in a good agreement with available literature data.

  2. Influence of Secondary Interactions on the Structure, Sublimation Thermodynamics, and Solubility of Salicylate:4-Hydroxybenzamide Cocrystals. Combined Experimental and Theoretical Study.

    Science.gov (United States)

    Manin, Alex N; Voronin, Alexander P; Shishkina, Anastasia V; Vener, Mikhail V; Churakov, Andrei V; Perlovich, German L

    2015-08-20

    Cocrystal screening of 4-hydroxybenzamide with a number of salicylates (salicylic acid, SA; 4-aminosalicylic acid, PASA; acetylsalicylic acid, ASA; and salicylsalicylic acid, SSA) was conducted to confirm the formation of two cocrystals, [SA+4-OHBZA] (1:1) and [PASA+4-OHBZA] (1:1). Their structures were determined using single-crystal X-ray diffraction, and the hydrogen-bond network topology was studied. Thermodynamic characteristics of salicylic acid cocrystal sublimation were obtained experimentally. It was proved that PASA cocrystallization with 4-OHBZA makes the drug more stable and prevents the irreversible process of decarboxylation of PASA resulting in formation of toxic 3-aminophenol. The pattern of non-covalent interactions in the cocrystals is described quantitatively using solid-state density functional theory followed by Bader analysis of the periodic electron density. It has been found that the total energy of secondary interactions between synthon atoms and the side hydroxyl group of the acid molecule in [SA+4-OHBZA] (1:1) and [PASA+4-OHBZA] (1:1) cocrystals is comparable to the energy of the primary acid-amide heterosynthon. The theoretical value of the sublimation enthalpy of [SA+4-OHBZA], 231 kJ/mol, agrees fairly well with the experimental one, 272 kJ/mol. The dissolution experiments with [SA+4-OHBZA] have proved that the relatively large cocrystal stability in relation to the stability of its components has a negative effect on the dissolution rate and equilibrium solubility. The [PASA+4-OHBZA] (1:1) cocrystal showed an enhancement of apparent solubility compared to that of the corresponding pure active pharmaceutical ingredient, while their intrinsic dissolution rates are comparable.

  3. Calculation of the surface free energy of fcc copper nanoparticles

    International Nuclear Information System (INIS)

    Jia Ming; Lai Yanqing; Tian Zhongliang; Liu Yexiang

    2009-01-01

    Using molecular dynamics simulations with the modified analytic embedded-atom method we calculate the Gibbs free energy and surface free energy for fcc Cu bulk, and further obtain the Gibbs free energy of nanoparticles. Based on the Gibbs free energy of nanoparticles, we have investigated the heat capacity of copper nanoparticles. Calculation results indicate that the Gibbs free energy and the heat capacity of nanoparticles can be divided into two parts: bulk quantity and surface quantity. The molar heat capacity of the bulk sample is lower compared with the molar heat capacity of nanoparticles, and this difference increases with the decrease in the particle size. It is also observed that the size effect on the thermodynamic properties of Cu nanoparticles is not really significant until the particle is less than about 20 nm. It is the surface atoms that decide the size effect on the thermodynamic properties of nanoparticles

  4. Measurement of the enthalpies of vaporization and sublimation of solids aromatic hydrocarbons by differential scanning calorimetry

    International Nuclear Information System (INIS)

    Rojas, Aaron; Orozco, Eulogio

    2003-01-01

    An experimental procedure is proposed for direct measurement of the heat involved in the vaporization of a solid organic compound above its normal melting temperature. This technique consists on the fusion of a solid aromatic hydrocarbon, which is then vaporized by a sudden decrease of the pressure. The direct register of heat flow as function of time by differential scanning calorimetry allows the quantifying of the enthalpy of vaporization of compounds such as phenanthrene, β-naphthol, pyrene, and anthracene. Enthalpies of vaporization were measured in an isothermal mode over a range of temperatures from 10 to 20 K above the melting temperatures of each compound, while enthalpies of fusion were determined from separate experiments performed in a scanning mode. Enthalpies of sublimation are computed from results of fusion and vaporization, and then compared with results from the literature, which currently are obtained by calorimetric or indirect techniques

  5. Lepanto, before and after: Between the Republic and the Sublime Porte

    Directory of Open Access Journals (Sweden)

    Özlem KUMRUlAR

    2014-12-01

    Full Text Available The loss of Cyprus to the ottoman Turks, hand in hand with the Battle of Lepanto was the major reason of a period of frozen politics and caused the breaking of the traditional peace between Venice and Constantinople. Yet there is a notable difference between the historical and political Conseptualization of these two major episodes. The ottoman state didn’t interpret this catastrophe as the Republic did. As, it could be seen from the bilateral diplomacy carried out by both states, neither the loss of Cyprus, nor the myth-creating Lepanto could change the classical oriental policy of the Serenissima. The case was not different for the Sublime Porte. The aim of this paper is to analyse the post-war politics of these two states and the noteable change in the political polarization in Europe in the milieu of the ottoman-Hapsburg rivalry.

  6. Concentration of noble metals by sublimation during the analysis of massive samples

    International Nuclear Information System (INIS)

    Chuburkov, Yu.T.; Zhujkov, B.L.; Gehrbish, Sh.; Al'pert, L.K.; Chan Zuj Ty

    1990-01-01

    The possibility of concentrating noble metals from terrestrial samples of various composition by chemical sublimation in an air stream at a temperature of 1000-1200 deg C was examined. It was found that the chemical yields of Au, Pt, Ir, Ru, Os and Re for all the samples increased by introducing solid additives of FeCl 2 , TiO 2 and Nb 2 O 5 . The concentration technique provides the possibility of determining some noble metals in massive samples (up to 50 g) with widely ranging element contents. By using gamma and neutron activation on a microtron, the detection limits of 3x10 -2 ppm for Pt and Ir and 4x10 -3 ppm for Au were achieved. In the case of X-ray fluorescence analysis, the detection limit for these elements was 0.4 ppm

  7. Formation of the molecular crystal structure during the vacuum sublimation of paracetamol

    Science.gov (United States)

    Belyaev, A. P.; Rubets, V. P.; Antipov, V. V.; Bordei, N. S.

    2015-04-01

    The results from structural and thermal studies on the formation of molecular crystals during the vacuum sublimation of paracetamol from its vapor phase are given. It is established that the vapor-crystal phase transition proceeds in a complicated way as the superposition of two phase transitions: a first-order phase transition with a change in density, and a second-order phase transition with a change in ordering. It is shown that the latter is a smeared phase transition that proceeds with the formation of a pretransitional phase that is irreversibly dissipated during phase transformation, leading to the formation of crystals of the rhombic syngony. Data from differential scanning calorimetry and X-ray diffraction analysis are presented along with microphotographs.

  8. Paths of the Sublime: Alain de Botton’s The Art of Travel

    Directory of Open Access Journals (Sweden)

    M.C.C. Mendes

    2015-05-01

    Full Text Available Bearing in mind the central place of literary, academic, and religious tourism in Cultural Studies and in Alain de Botton’s The Art of Travel (2002, the paper seeks: 1 to identify some remarkable travels of famous writers – the British Wordsworth; the French Karl-Joris Huysmans, Gustave Flaubert, and Charles Baudelaire; 2 to show that in the analysis of such authors’ itineraries (from Europe to the East, there is a search for cultural roots, a mapping of spaces and people, and a deconstruction of labels often related to the Other; 3 to point out that the tourist is also a storyteller, a protagonist, and a creator of fictional worlds; 4 to bring together literary tourism and artistic tourism, through the identification of allusions to other cultural events (painting, music, and architecture; 5 to characterize tourism as a literary and aesthetic experience of the Sublime.

  9. Synthesis of gallium nitride and related oxides via ammonobasic reactive sublimation (ARS)

    Energy Technology Data Exchange (ETDEWEB)

    Hernández-Hernández, Luis Alberto; Aguilar-Hernández, Jorge R.; Mejía-García, Concepción; Cruz-Gandarilla, Francisco; Contreras-Puente, Gerardo [Escuela Superior de Física y Matemáticas, Instituto Politécnico Nacional, Ciudad de México (Mexico); Moure-Flores, Francisco de [Facultad de Química, Materiales-Energía, Universidad Autónoma de Querétaro (Mexico); Melo-Pereira, Osvaldo de, E-mail: schwarzerengelxv@hotmail.com [Facultad de Física, Universidad de La Habana, La Habana (Cuba)

    2017-11-15

    Ammonobasic reactive sublimation (ARS) is proposed as a novel method to synthesize GaN and related oxides. Results indicate that GaN growth occurs by a nitriding process of Ga and related oxides, establishing a direct dependence on NH{sub 4} OH amount added as a primary chemical reactive. The samples were grown on p-type Si (111) substrates inside a tube furnace, employing GaN powder and NH{sub 4} OH. The characterizations of the samples were carried out by XRD, SEM, EDS and PL techniques, revealing the influence of NH{sub 4} OH on the improvement of GaN synthesis and the enhancement of its optical and structural properties. (author)

  10. Selective Area Sublimation: A Simple Top-down Route for GaN-Based Nanowire Fabrication.

    Science.gov (United States)

    Damilano, B; Vézian, S; Brault, J; Alloing, B; Massies, J

    2016-03-09

    Post-growth in situ partial SiNx masking of GaN-based epitaxial layers grown in a molecular beam epitaxy reactor is used to get GaN selective area sublimation (SAS) by high temperature annealing. Using this top-down approach, nanowires (NWs) with nanometer scale diameter are obtained from GaN and InxGa1-xN/GaN quantum well epitaxial structures. After GaN regrowth on InxGa1-xN/GaN NWs resulting from SAS, InxGa1-xN quantum disks (QDisks) with nanometer sizes in the three dimensions are formed. Low temperature microphotoluminescence experiments demonstrate QDisk multilines photon emission around 3 eV with individual line widths of 1-2 meV.

  11. The role of defects in fluorescent silicon carbide layers grown by sublimation epitaxy

    DEFF Research Database (Denmark)

    Schimmel, Saskia; Kaiser, Michl; Jokubavicius, Valdas

    Donor-acceptor co-doped silicon carbide layers are promising light converters for novel monolithic all-semiconductor LEDs due to their broad-band donor-acceptor pair luminescence and potentially high internal quantum efficiency. Besides appropriate doping concentrations yielding low radiative...... lifetimes, high nonradiative lifetimes are crucial for efficient light conversion. Despite the excellent crystalline quality that can generally be obtained by sublimation epitaxy according to XRD measurements, the role of defects in f-SiC is not yet well understood. Recent results from room temperature...... photoluminescence, charge carrier lifetime measurements by microwave detected photoconductivity and internal quantum efficiency measurements suggest that the internal quantum efficiency of f-SiC layers is significantly affected by the incorporation of defects during epitaxy. Defect formation seems to be related...

  12. Laboratory studies of the growth, sublimation, and light- scattering properties of single levitated ice particles

    Science.gov (United States)

    Bacon, Neil Julian

    2001-12-01

    I describe experiments to investigate the properties of microscopic ice particles. The goal of the work was to measure parameters that are important in cloud processes and radiative transfer, using a novel technique that avoids the use of substrates. The experiments were conducted in two separate electrodynamic balance chambers. Single, charged ice particles were formed from frost particles or from droplets frozen either homogeneously or heteroge neously with a bionucleant. The particles were trapped at temperatures between -38°C and -4°C and grown or sublimated according to the temperature gradient in the cham ber. I describe observations of breakup of sublimating frost particles, measurements of light scattering by hexagonal crystals, and observations of the morphology of ice particles grown from frozen water droplets and frost particles. The breaking strength of frost particles was an order of magnitude less than that of bulk ice. Light scattering features not previously observed were analyzed and related to crystal dimension. Initial results from a computer model failed to reproduce these features. The widths of scattering peaks suggest that surface roughness may play a role in determining the angular distribution of scattered light. Ice particle mass evolution was found to be consistent with diffusion- limited growth. Crystals grown slowly from frozen droplets adopted isometric habits, while faster growth resulted in thin side-planes, although there was not an exact correspondence between growth conditions and particle morphology. From the morphological transition, I infer lower limits for the critical supersaturation for layer nucleation on the prism face of 2.4% at -15°C, 4.4% at -20°C, and 3.1% at -25°C. Analytic expressions for the size dependence of facet stability are developed, indicating a strong dependence of stability on both crystal size and surface kinetics, and compared with data. I discuss the role of complex particle morphologies in

  13. A Low Cost Inflatable CubeSat Drag Brake Utilizing Sublimation

    Science.gov (United States)

    Horn, Adam Charles

    The United Nations Inter-Agency Debris Coordination Committee has adopted a 25-year post-mission lifetime requirement for any satellite orbiting below 2000 km in order to mitigate the growing orbital debris threat. Low-cost CubeSats have become important satellite platforms with startling capabilities, but this guideline restricts them to altitudes below 600 km because they remain in orbit too long. In order to enable CubeSat deployments at higher release altitudes, a low-cost, ultra-reliable deorbit device is needed. This thesis reports on efforts to develop a deployable and passively inflatable drag brake that can deorbit from higher orbital altitudes, thereby complying with the 25-year orbital lifetime guideline. On the basis of concepts first implemented during the NASA Echo Satellite Project, this study investigated the design of an inflatable CubeSat drag device that utilizes sublimating benzoic acid powder as the inflation propellant. Testing has focused on demonstrating the functionality of charging a Mylar drag brake bladder with appropriate quantities of benzoic acid powder, and the exposure to a controlled-temperature vacuum chamber causing the bladder to inflate. Although results show a measureable increase in internal pressure when introduced to anticipated orbital temperatures, a significant air-derived expansion prior to sublimation was encountered due to the undetectable volume of ambient residual air in the fabricated membrane bladders. These tests have demonstrated the feasibility of this approach, thereby demonstrating that this concept can create a potentially smaller and less expensive drag device, eliminating inflation gas tanks and valves. In that way, this system can provide a low-cost, miniaturized system that reduces a CubeSat's orbital lifetime to less than 25 years, when placed at higher orbital altitude.

  14. CURVED WALLS: GRAIN GROWTH, SETTLING, AND COMPOSITION PATTERNS IN T TAURI DISK DUST SUBLIMATION FRONTS

    Energy Technology Data Exchange (ETDEWEB)

    McClure, M. K.; Calvet, N.; Hartmann, L.; Ingleby, L. [Department of Astronomy, The University of Michigan, 500 Church Street, 830 Dennison Building., Ann Arbor, MI 48109 (United States); D' Alessio, P. [Centro de Radioastronomía y Astrofísica, Universidad Nacional Autónoma de México, 58089 Morelia, Michoacán (Mexico); Espaillat, C. [Center for Astrophysics, 60 Garden Street, Cambridge, MA 02138 (United States); Sargent, B. [Center for Imaging Science and Laboratory for Multiwavelength Astrophysics, Rochester Institute of Technology, 54 Lomb Memorial Drive, Rochester, NY 14623 (United States); Watson, D. M. [Department of Physics and Astronomy, University of Rochester, Rochester, NY 14627 (United States); Hernández, J., E-mail: melisma@umich.edu, E-mail: ncalvet@umich.edu, E-mail: lhartm@umich.edu, E-mail: lingleby@umich.edu, E-mail: p.dalessio@astrosmo.unam.mx, E-mail: cespaillat@cfa.harvard.edu, E-mail: baspci@rit.edu, E-mail: dmw@pas.rochester.edu, E-mail: hernandj@cida.ve [Centro de Investigaciones de Astronomía (CIDA), Mérida 5101-A (Venezuela, Bolivarian Republic of)

    2013-10-01

    The dust sublimation walls of disks around T Tauri stars represent a directly observable cross-section through the disk atmosphere and midplane. Their emission properties can probe the grain size distribution and composition of the innermost regions of the disk, where terrestrial planets form. Here we calculate the inner dust sublimation wall properties for four classical T Tauri stars with a narrow range of spectral types and inclination angles and a wide range of mass accretion rates to determine the extent to which the walls are radially curved. Best fits to the near- and mid-IR excesses are found for curved, two-layer walls in which the lower layer contains larger, hotter, amorphous pyroxene grains with Mg/(Mg+Fe) = 0.6 and the upper layer contains submicron, cooler, mixed amorphous olivine and forsterite grains. As the mass accretion rates decrease from 10{sup –8} to 10{sup –10} M{sub ☉} yr{sup –1}, the maximum grain size in the lower layer decreases from ∼3 to 0.5 μm. We attribute this to a decrease in fragmentation and turbulent support for micron-sized grains with decreasing viscous heating. The atmosphere of these disks is depleted of dust with dust-gas mass ratios 1 × 10{sup –4} of the interstellar medium (ISM) value, while the midplane is enhanced to eight times the ISM value. For all accretion rates, the wall contributes at least half of the flux in the optically thin 10 μm silicate feature. Finally, we find evidence for an iron gradient in the disk, suggestive of that found in our solar system.

  15. The political sublime. reading Kok Nam, Mozambican photographer (1939-2012

    Directory of Open Access Journals (Sweden)

    Rui Assubuji

    Full Text Available Kok Nam began his photographic career at Studio Focus in Lourenco Marques in the 1950s, graduated to the newspaper Noticias and joined Tempo magazine in the early 1970s. Most recently he worked at the journal Savana as a photojournalist and later director. This article opens with an account of the relationship that developed between Kok Nam and the late President Samora Machel, starting with the photographer's portrait of Machel in Nachingwea in November 1974 before Independence. It traces an arc through the Popular Republic (1976-1990 from political revelation at its inception to the difficult years of civil war and Machel's death in the plane crash at Mbuzini in 1986. The article then engages in a series of photo-commentaries across a selection of Kok Nam's photographs, several published in their time but others selected retrospectively by Kok Nam for later exhibition and circulation. The approach taken is that of 'association', exploring the connections between the photographs, their histories both then and in the intervening years and other artifacts and mediums of cultural expression that deal with similar issues or signifiers picked up in the images. Among the signifiers picked up in the article are soldiers, pigs, feet, empty villages, washing, doves and bridges. The central argument is that Kok Nam participated with many others in a kind of collective hallucination during the Popular Republic, caught up in the 'political sublime'. Later Kok Nam shows many signs of a photographic 'second thinking' that sought out a more delicate sublime in his own archive.

  16. CURVED WALLS: GRAIN GROWTH, SETTLING, AND COMPOSITION PATTERNS IN T TAURI DISK DUST SUBLIMATION FRONTS

    International Nuclear Information System (INIS)

    McClure, M. K.; Calvet, N.; Hartmann, L.; Ingleby, L.; D'Alessio, P.; Espaillat, C.; Sargent, B.; Watson, D. M.; Hernández, J.

    2013-01-01

    The dust sublimation walls of disks around T Tauri stars represent a directly observable cross-section through the disk atmosphere and midplane. Their emission properties can probe the grain size distribution and composition of the innermost regions of the disk, where terrestrial planets form. Here we calculate the inner dust sublimation wall properties for four classical T Tauri stars with a narrow range of spectral types and inclination angles and a wide range of mass accretion rates to determine the extent to which the walls are radially curved. Best fits to the near- and mid-IR excesses are found for curved, two-layer walls in which the lower layer contains larger, hotter, amorphous pyroxene grains with Mg/(Mg+Fe) = 0.6 and the upper layer contains submicron, cooler, mixed amorphous olivine and forsterite grains. As the mass accretion rates decrease from 10 –8 to 10 –10 M ☉ yr –1 , the maximum grain size in the lower layer decreases from ∼3 to 0.5 μm. We attribute this to a decrease in fragmentation and turbulent support for micron-sized grains with decreasing viscous heating. The atmosphere of these disks is depleted of dust with dust-gas mass ratios 1 × 10 –4 of the interstellar medium (ISM) value, while the midplane is enhanced to eight times the ISM value. For all accretion rates, the wall contributes at least half of the flux in the optically thin 10 μm silicate feature. Finally, we find evidence for an iron gradient in the disk, suggestive of that found in our solar system

  17. Iapetus Surface Temperatures, and the Influence of Sublimation on the Albedo Dichotomy: Cassini CIRS Constraints

    Science.gov (United States)

    Spencer, J. R.; Pearl, J. C.; Segura, M.; Cassini CIRS Team

    2005-08-01

    The Composite Infrared Spectrometer (CIRS) on the Cassini orbiter obtained extensive observations of Iapetus' thermal emission during the New Year 2005 flyby, with best 8 - 16 μ m spatial resolution of 35 km per pixel. Observed subsolar temperatures on the dark terrain reach nearly 130 K, much warmer than any other satellite surface in the Saturn system, due to the combination of low albedo and slow rotation. These high temperatures mean that, uniquely in the Saturn system, water ice sublimation rates are significant at low latitudes on Iapetus' dark side, and surface water ice is probably not stable there on geological timescales. This result is consistent with the lack of water ice at low latitudes on the dark terrain inferred from Cassini UVIS UV spectra (Hendrix et al., 2005 LPSC). Thermally-controlled migration of water ice may thus contribute to the curious shape of the light/dark boundary on Iapetus, with bright poles and dark terrain extending round the equator onto the trailing side. Impacts of Saturn-centric or prograde heliocentric material cannot alone explain this shape, as their impact flux depends only on distance from the apex of motion (though the impact distribution of Oort cloud comet dust may be consistent with the observed albedo pattern (Cook and Franklin 1970)). We model the ballistic migration of water ice across the surface of Iapetus, determining temperatures and sublimation rates assuming CIRS-constrained thermal inertia and a simple dependence of albedo on distance from the apex of motion. Water ice is lost rapidly from low latitudes on the dark leading side and accumulates near the poles, and is also lost, though more slowly, in equatorial regions near the sub-Saturn and anti-Saturn points. The resulting water ice distribution pattern matches the distribution of Iapetus' bright terrain remarkably well. Albedo modification by thermal migration can thus help to reconcile Iapetus' albedo patterns with albedo control by Saturn-centric or

  18. Taking a Hike and Hucking the Stout: The Troublesome Legacy of the Sublime in Outdoor Recreation

    Directory of Open Access Journals (Sweden)

    Georg Drennig

    2013-12-01

    Full Text Available As Henry Thoreau noted in the 1850s, the simple act of walking can be loaded with political and spiritual meaning. Today, taking a hike as an act of engaging in outdoor recreation is equally non-trivial, and therefore subject of the following analysis. As this paper argues, outdoors recreation is still influenced by the legacy of the Sublime and its construction of wilderness. This troublesome legacy means that the cultural self-representation of outdoor sports – and the practice itself – lays claim to the environment in ways that are socially and sometimes even ethni-cally exclusive. This essay uses William Cronon’s critique of the cultural constructedness of wilderness as a point of departure to see how Western notions of sublime nature have an impact on spatial practice. The elevation of specific parts of the environ-ment into the category of wilderness prescribes certain uses and meanings as na-ture is made into an antidote against the ills of industrial civilization, and a place where the alienated individual can return to a more authentic self. This view then has become a troublesome legacy, informing the cultural self-representation of those uses of “wilderness” that are known as outdoor recreation. In its cultural production, outdoors recreation constructs “healthy” and “athlet-ic” bodies exercising in natural settings and finding refuge from the everyday al-ienation of postmodern society. Yet these bodies are conspicuously white, and the obligatory equipment and fashion expensive. Outdoor recreation is a privileged assertion of leisure, often denoting an urban, affluent, and white, background of the practitioner. These practitioners then lay exclusive claim on the landscapes they use. As trivial as taking a hike or any other form of outdoors recreation may thus seem, they put a cultural legacy into practice that is anything but trivial.

  19. Dynamics of macro-observables and space-time inhomogeneous Gibbs ensembles

    International Nuclear Information System (INIS)

    Lanz, L.; Lupieri, G.

    1978-01-01

    The relationship between the classical description of a macro-system and quantum mechanics of its particles is considered within the framework recently developed by Ludwig. A procedure is given to define probability measures on the trajectory space of a macrosystem which yields a statistical description of the dynamics of a macrosystem. The basic tool in this treatment is a new concept of space-time inhomogeneous Gibbs ensemble, defined in N-body quantum mechanics. In the Gaussian approximation of the probabilities the results of Zubarev's theory based on the ''nonequilibrium statistical operator'' are recovered. The present ''embedding'' of the description of a macrosystem inside the N-body theory allows for a joint description of a macrosystem and a microsubsystem of it, and a ''macroscopical'' calculation of the statistical operator of the microsystem is indicated. (author)

  20. The osmotic second virial coefficient and the Gibbs-McMillan-Mayer framework

    DEFF Research Database (Denmark)

    Mollerup, J.M.; Breil, Martin Peter

    2009-01-01

    The osmotic second virial coefficient is a key parameter in light scattering, protein crystallisation. self-interaction chromatography, and osmometry. The interpretation of the osmotic second virial coefficient depends on the set of independent variables. This commonly includes the independent...... variables associated with the Kirkwood-Buff, the McMillan-Mayer, and the Lewis-Randall solution theories. In this paper we analyse the osmotic second virial coefficient using a Gibbs-McMillan-Mayer framework which is similar to the McMillan-Mayer framework with the exception that pressure rather than volume...... is an independent variable. A Taylor expansion is applied to the osmotic pressure of a solution where one of the solutes is a small molecule, a salt for instance, that equilibrates between the two phases. Other solutes are retained. Solvents are small molecules that equilibrate between the two phases...

  1. A course on large deviations with an introduction to Gibbs measures

    CERN Document Server

    Rassoul-Agha, Firas

    2015-01-01

    This is an introductory course on the methods of computing asymptotics of probabilities of rare events: the theory of large deviations. The book combines large deviation theory with basic statistical mechanics, namely Gibbs measures with their variational characterization and the phase transition of the Ising model, in a text intended for a one semester or quarter course. The book begins with a straightforward approach to the key ideas and results of large deviation theory in the context of independent identically distributed random variables. This includes Cramér's theorem, relative entropy, Sanov's theorem, process level large deviations, convex duality, and change of measure arguments. Dependence is introduced through the interactions potentials of equilibrium statistical mechanics. The phase transition of the Ising model is proved in two different ways: first in the classical way with the Peierls argument, Dobrushin's uniqueness condition, and correlation inequalities and then a second time through the ...

  2. Scan Order in Gibbs Sampling: Models in Which it Matters and Bounds on How Much.

    Science.gov (United States)

    He, Bryan; De Sa, Christopher; Mitliagkas, Ioannis; Ré, Christopher

    2016-01-01

    Gibbs sampling is a Markov Chain Monte Carlo sampling technique that iteratively samples variables from their conditional distributions. There are two common scan orders for the variables: random scan and systematic scan. Due to the benefits of locality in hardware, systematic scan is commonly used, even though most statistical guarantees are only for random scan. While it has been conjectured that the mixing times of random scan and systematic scan do not differ by more than a logarithmic factor, we show by counterexample that this is not the case, and we prove that that the mixing times do not differ by more than a polynomial factor under mild conditions. To prove these relative bounds, we introduce a method of augmenting the state space to study systematic scan using conductance.

  3. Ergodic time-reversible chaos for Gibbs' canonical oscillator

    International Nuclear Information System (INIS)

    Hoover, William Graham; Sprott, Julien Clinton; Patra, Puneet Kumar

    2015-01-01

    Nosé's pioneering 1984 work inspired a variety of time-reversible deterministic thermostats. Though several groups have developed successful doubly-thermostated models, single-thermostat models have failed to generate Gibbs' canonical distribution for the one-dimensional harmonic oscillator. A 2001 doubly-thermostated model, claimed to be ergodic, has a singly-thermostated version. Though neither of these models is ergodic this work has suggested a successful route toward singly-thermostated ergodicity. We illustrate both ergodicity and its lack for these models using phase-space cross sections and Lyapunov instability as diagnostic tools. - Highlights: • We develop cross-section and Lyapunov methods for diagnosing ergodicity. • We apply these methods to several thermostatted-oscillator problems. • We demonstrate the nonergodicity of previous work. • We find a novel family of ergodic thermostatted-oscillator problems.

  4. Empirical Statistical Power for Testing Multilocus Genotypic Effects under Unbalanced Designs Using a Gibbs Sampler

    Directory of Open Access Journals (Sweden)

    Chaeyoung Lee

    2012-11-01

    Full Text Available Epistasis that may explain a large portion of the phenotypic variation for complex economic traits of animals has been ignored in many genetic association studies. A Baysian method was introduced to draw inferences about multilocus genotypic effects based on their marginal posterior distributions by a Gibbs sampler. A simulation study was conducted to provide statistical powers under various unbalanced designs by using this method. Data were simulated by combined designs of number of loci, within genotype variance, and sample size in unbalanced designs with or without null combined genotype cells. Mean empirical statistical power was estimated for testing posterior mean estimate of combined genotype effect. A practical example for obtaining empirical statistical power estimates with a given sample size was provided under unbalanced designs. The empirical statistical powers would be useful for determining an optimal design when interactive associations of multiple loci with complex phenotypes were examined.

  5. Robust identification of transcriptional regulatory networks using a Gibbs sampler on outlier sum statistic.

    Science.gov (United States)

    Gu, Jinghua; Xuan, Jianhua; Riggins, Rebecca B; Chen, Li; Wang, Yue; Clarke, Robert

    2012-08-01

    Identification of transcriptional regulatory networks (TRNs) is of significant importance in computational biology for cancer research, providing a critical building block to unravel disease pathways. However, existing methods for TRN identification suffer from the inclusion of excessive 'noise' in microarray data and false-positives in binding data, especially when applied to human tumor-derived cell line studies. More robust methods that can counteract the imperfection of data sources are therefore needed for reliable identification of TRNs in this context. In this article, we propose to establish a link between the quality of one target gene to represent its regulator and the uncertainty of its expression to represent other target genes. Specifically, an outlier sum statistic was used to measure the aggregated evidence for regulation events between target genes and their corresponding transcription factors. A Gibbs sampling method was then developed to estimate the marginal distribution of the outlier sum statistic, hence, to uncover underlying regulatory relationships. To evaluate the effectiveness of our proposed method, we compared its performance with that of an existing sampling-based method using both simulation data and yeast cell cycle data. The experimental results show that our method consistently outperforms the competing method in different settings of signal-to-noise ratio and network topology, indicating its robustness for biological applications. Finally, we applied our method to breast cancer cell line data and demonstrated its ability to extract biologically meaningful regulatory modules related to estrogen signaling and action in breast cancer. The Gibbs sampler MATLAB package is freely available at http://www.cbil.ece.vt.edu/software.htm. xuan@vt.edu Supplementary data are available at Bioinformatics online.

  6. Sublimation of icy planetesimals and the delivery of water to the habitable zone around solar type stars

    Science.gov (United States)

    Brunini, Adrián; López, María Cristina

    2018-06-01

    We present a semi analytic model to evaluate the delivery of water to the habitable zone around a solar type star carried by icy planetesimals born beyond the snow line. The model includes sublimation of ice, gas drag and scattering by an outer giant planet located near the snow line. The sublimation model is general and could be applicable to planetary synthesis models or N-Body simulations of the formation of planetary systems. We perform a short series of simulations to asses the potential relevance of sublimation of volatiles in the process of delivery of water to the inner regions of a planetary system during early stages of its formation. We could anticipate that erosion by sublimation would prevent the arrival of much water to the habitable zone of protoplanetary disks in the form of icy planetesimals. Close encounters with a massive planet orbiting near the outer edge of the snow line could make possible for planetesimals to reach the habitable zone somewhat less eroded. However, only large planetesimals could provide appreciable amounts of water. Massive disks and sharp gas surface density profiles favor icy planetesimals to reach inner regions of a protoplanetary disk.

  7. Thermodynamic study of alkane-α,ω-diamines - evidence of odd-even pattern of sublimation properties

    Czech Academy of Sciences Publication Activity Database

    Fulem, Michal; Růžička, K.; Červinka, C.; Bazyleva, A.; Della Gatta, G.

    2014-01-01

    Roč. 371, Jun (2014), s. 93-105 ISSN 0378-3812 Institutional support: RVO:68378271 Keywords : alkane-diamines * odd–even effect * vapor pressure * sublimation and vaporization thermodynamic properties * statistical thermodynamics Subject RIV: BM - Solid Matter Physics ; Magnetism Impact factor: 2.200, year: 2014

  8. Studies of CdS/CdTe interface: Comparison of CdS films deposited by close space sublimation and chemical bath deposition techniques

    Energy Technology Data Exchange (ETDEWEB)

    Han, Jun-feng, E-mail: pkuhjf@bit.edu.cn [Institut des Matériaux Jean Rouxel (IMN), Université de Nantes, UMR CNRS 6502, 2 rue de la Houssinière, BP 32229, 44322 Nantes Cedex 3 (France); Institute of Materials Science, Darmstadt University of Technology, Petersenstr. 23, 64287 Darmstadt (Germany); School of Physics, Beijing Institute of Technology, Beijing 100081 (China); Fu, Gan-hua; Krishnakumar, V.; Schimper, Hermann-Josef [Institute of Materials Science, Darmstadt University of Technology, Petersenstr. 23, 64287 Darmstadt (Germany); Liao, Cheng [Department of Physics, Peking University, Beijing 100871 (China); Jaegermann, Wolfram [Institute of Materials Science, Darmstadt University of Technology, Petersenstr. 23, 64287 Darmstadt (Germany); Besland, M.P. [Institut des Matériaux Jean Rouxel (IMN), Université de Nantes, UMR CNRS 6502, 2 rue de la Houssinière, BP 32229, 44322 Nantes Cedex 3 (France)

    2015-05-01

    The CdS layers were deposited by two different methods, close space sublimation (CSS) and chemical bath deposition (CBD) technique. The CdS/CdTe interface properties were investigated by transmission electron microscope (TEM) and X-ray photoelectron spectroscopy (XPS). The TEM images showed a large CSS-CdS grain size in the range of 70-80 nm. The interface between CSS-CdS and CdTe were clear and sharp, indicating an abrupt hetero-junction. On the other hand, CBD-CdS layer had much smaller grain size in the 5-10 nm range. The interface between CBD-CdS and CdTe was not as clear as CSS-CdS. With the stepwise coverage of CdTe layer, the XPS core levels of Cd 3d and S 2p in CSS-CdS had a sudden shift to lower binding energies, while those core levels shifted gradually in CBD-CdS. In addition, XPS depth profile analyses indicated a strong diffusion in the interface between CBD-CdS and CdTe. The solar cells prepared using CSS-CdS yielded better device performance than the CBD-CdS layer. The relationships between the solar cell performances and properties of CdS/CdTe interfaces were discussed. - Highlights: • Studies of CdS deposited by close space sublimation and chemical bath deposition • An observation of CdS/CdTe interface by transmission electron microscope • A careful investigation of CdS/CdTe interface by X ray photoelectron spectra • An easier diffusion at the chemical bath deposition CdS and CdTe interface.

  9. Gibbs Ensemble Simulation on Polarizable Models: Vapor-liquid Equilibrium in Baranyai-Kiss Models of Water

    Czech Academy of Sciences Publication Activity Database

    Moučka, F.; Nezbeda, Ivo

    2013-01-01

    Roč. 360, DEC 25 (2013), s. 472-476 ISSN 0378-3812 Grant - others:GA MŠMT(CZ) LH12019 Institutional support: RVO:67985858 Keywords : multi-particle move monte carlo * Gibbs ensemble * vapor-liquid-equilibria Subject RIV: CF - Physical ; Theoretical Chemistry Impact factor: 2.241, year: 2013

  10. The importance of the photosynthetic Gibbs effect in the elucidation of the Calvin-Benson-Bassham cycle.

    Science.gov (United States)

    Ebenhöh, Oliver; Spelberg, Stephanie

    2018-02-19

    The photosynthetic carbon reduction cycle, or Calvin-Benson-Bassham (CBB) cycle, is now contained in every standard biochemistry textbook. Although the cycle was already proposed in 1954, it is still the subject of intense research, and even the structure of the cycle, i.e. the exact series of reactions, is still under debate. The controversy about the cycle's structure was fuelled by the findings of Gibbs and Kandler in 1956 and 1957, when they observed that radioactive 14 CO 2 was dynamically incorporated in hexoses in a very atypical and asymmetrical way, a phenomenon later termed the 'photosynthetic Gibbs effect'. Now, it is widely accepted that the photosynthetic Gibbs effect is not in contradiction to the reaction scheme proposed by CBB, but the arguments given have been largely qualitative and hand-waving. To fully appreciate the controversy and to understand the difficulties in interpreting the Gibbs effect, it is illustrative to illuminate the history of the discovery of the CBB cycle. We here give an account of central scientific advances and discoveries, which were essential prerequisites for the elucidation of the cycle. Placing the historic discoveries in the context of the modern textbook pathway scheme illustrates the complexity of the cycle and demonstrates why especially dynamic labelling experiments are far from easy to interpret. We conclude by arguing that it requires sound theoretical approaches to resolve conflicting interpretations and to provide consistent quantitative explanations. © 2018 The Author(s).

  11. How Does the Gibbs Inequality Condition Affect the Stability and Detachment of Floating Spheres from the Free Surface of Water?

    Science.gov (United States)

    Feng, Dong-xia; Nguyen, Anh V

    2016-03-01

    Floating objects on the air-water interfaces are central to a number of everyday activities, from walking on water by insects to flotation separation of valuable minerals using air bubbles. The available theories show that a fine sphere can float if the force of surface tension and buoyancies can support the sphere at the interface with an apical angle subtended by the circle of contact being larger than the contact angle. Here we show that the pinning of the contact line at the sharp edge, known as the Gibbs inequality condition, also plays a significant role in controlling the stability and detachment of floating spheres. Specifically, we truncated the spheres with different angles and used a force sensor device to measure the force of pushing the truncated spheres from the interface into water. We also developed a theoretical modeling to calculate the pushing force that in combination with experimental results shows different effects of the Gibbs inequality condition on the stability and detachment of the spheres from the water surface. For small angles of truncation, the Gibbs inequality condition does not affect the sphere detachment, and hence the classical theories on the floatability of spheres are valid. For large truncated angles, the Gibbs inequality condition determines the tenacity of the particle-meniscus contact and the stability and detachment of floating spheres. In this case, the classical theories on the floatability of spheres are no longer valid. A critical truncated angle for the transition from the classical to the Gibbs inequality regimes of detachment was also established. The outcomes of this research advance our understanding of the behavior of floating objects, in particular, the flotation separation of valuable minerals, which often contain various sharp edges of their crystal faces.

  12. Modified solution calorimetry approach for determination of vaporization and sublimation enthalpies of branched-chain aliphatic and alkyl aromatic compounds at T = 298.15 K

    International Nuclear Information System (INIS)

    Varfolomeev, Mikhail A.; Novikov, Vladimir B.; Nagrimanov, Ruslan N.; Solomonov, Boris N.

    2015-01-01

    Highlights: • Solution enthalpies of 18 branching-chain alkyl aromatic and aliphatic compounds in cyclohexane were measured. • Group contributions to the enthalpy of solvation due to branching and substitution in carbon chain were evaluated. • Modified solution calorimetry based approach for determination of vaporization/sublimation enthalpies was proposed. • This approach provides vaporization/sublimation enthalpies directly at T = 298.15 K. • Vaporization/sublimation enthalpies of 35 branched-chain alkyl aromatic and aliphatic compounds were determined. - Abstract: The enthalpies of solution, solvation and vaporization/sublimation are interrelated values combined in the simplest thermodynamic circle. Hence, experimental determination of vaporization/sublimation enthalpy can be substituted by experimentally simpler determination of solution enthalpy when solvation enthalpy is known. Previously it was found that solvation enthalpies of a wide range of unbranched aliphatic and aromatic solutes in saturated hydrocarbons are in good linear correlation with their molar refraction values. This allows to estimate the vaporization/sublimation enthalpy of any unbranched organic compound from its solution enthalpy in saturated hydrocarbon and molar refraction. In the present work this approach was modified for determination of vaporization/sublimation enthalpy of branched-chain alkyl aromatic and aliphatic compounds. Group contributions to the enthalpy of solvation due to the branching of carbon chain were evaluated. Enthalpies of solution at infinite dilution of 18 branched-chain aliphatic and alkyl aromatic compounds were measured at T = 298.15 K. Vaporization/sublimation enthalpies for 35 branched aliphatic and alkyl aromatic compounds were determined by using modified solution calorimetry approach. These values are in good agreement with available literature data on vaporization/sublimation enthalpies obtained by conventional methods.

  13. Thin film CdTe solar cells by close spaced sublimation: Recent results from pilot line

    International Nuclear Information System (INIS)

    Siepchen, B.; Drost, C.; Späth, B.; Krishnakumar, V.; Richter, H.; Harr, M.; Bossert, S.; Grimm, M.; Häfner, K.; Modes, T.; Zywitzki, O.; Morgner, H.

    2013-01-01

    CdTe is an attractive material to produce high efficient and low cost thin film solar cells. The semiconducting layers of this kind of solar cell can be deposited by the Close Spaced Sublimation (CSS) process. The advantages of this technique are high deposition rates and an excellent utilization of the raw material, leading to low production costs and competitive module prices. CTF Solar GmbH is offering equipment and process knowhow for the production of CdTe solar modules. For further improvement of the technology, research is done at a pilot line, which covers all relevant process steps for manufacture of CdTe solar cells. Herein, we present the latest results from the process development and our research activities on single functional layers as well as for complete solar cell devices. Efficiencies above 13% have already been obtained with Cu-free back contacts. An additional focus is set on different transparent conducting oxide materials for the front contact and a Sb 2 Te 3 based back contact. - Highlights: ► Laboratory established on industrial level for CdTe solar cell research ► 13.0% cell efficiency with our standard front contact and Cu-free back contact ► Research on ZnO-based transparent conducting oxide and Sb 2 Te 3 back contacts ► High resolution scanning electron microscopy analysis of ion polished cross section

  14. Limit order book and its modeling in terms of Gibbs Grand-Canonical Ensemble

    Science.gov (United States)

    Bicci, Alberto

    2016-12-01

    In the domain of so called Econophysics some attempts have been already made for applying the theory of thermodynamics and statistical mechanics to economics and financial markets. In this paper a similar approach is made from a different perspective, trying to model the limit order book and price formation process of a given stock by the Grand-Canonical Gibbs Ensemble for the bid and ask orders. The application of the Bose-Einstein statistics to this ensemble allows then to derive the distribution of the sell and buy orders as a function of price. As a consequence we can define in a meaningful way expressions for the temperatures of the ensembles of bid orders and of ask orders, which are a function of minimum bid, maximum ask and closure prices of the stock as well as of the exchanged volume of shares. It is demonstrated that the difference between the ask and bid orders temperatures can be related to the VAO (Volume Accumulation Oscillator), an indicator empirically defined in Technical Analysis of stock markets. Furthermore the derived distributions for aggregate bid and ask orders can be subject to well defined validations against real data, giving a falsifiable character to the model.

  15. Demonstration and resolution of the Gibbs paradox of the first kind

    International Nuclear Information System (INIS)

    Peters, Hjalmar

    2014-01-01

    The Gibbs paradox of the first kind (GP1) refers to the false increase in entropy which, in statistical mechanics, is calculated from the process of combining two gas systems S1 and S2 consisting of distinguishable particles. Presented in a somewhat modified form, the GP1 manifests as a contradiction to the second law of thermodynamics. Contrary to popular belief, this contradiction affects not only classical but also quantum statistical mechanics. This paper resolves the GP1 by considering two effects. (i) The uncertainty about which particles are located in S1 and which in S2 contributes to the entropies of S1 and S2. (ii) S1 and S2 are correlated by the fact that if a certain particle is located in one system, it cannot be located in the other. As a consequence, the entropy of the total system consisting of S1 and S2 is not the sum of the entropies of S1 and S2. (paper)

  16. Periodic p-adic Gibbs Measures of q-State Potts Model on Cayley Trees I: The Chaos Implies the Vastness of the Set of p-Adic Gibbs Measures

    Science.gov (United States)

    Ahmad, Mohd Ali Khameini; Liao, Lingmin; Saburov, Mansoor

    2018-06-01

    We study the set of p-adic Gibbs measures of the q-state Potts model on the Cayley tree of order three. We prove the vastness of the set of the periodic p-adic Gibbs measures for such model by showing the chaotic behavior of the corresponding Potts-Bethe mapping over Q_p for the prime numbers p≡1 (mod 3). In fact, for 0< |θ -1|_p< |q|_p^2 < 1 where θ =\\exp _p(J) and J is a coupling constant, there exists a subsystem that is isometrically conjugate to the full shift on three symbols. Meanwhile, for 0< |q|_p^2 ≤ |θ -1|_p< |q|_p < 1, there exists a subsystem that is isometrically conjugate to a subshift of finite type on r symbols where r ≥ 4. However, these subshifts on r symbols are all topologically conjugate to the full shift on three symbols. The p-adic Gibbs measures of the same model for the prime numbers p=2,3 and the corresponding Potts-Bethe mapping are also discussed. On the other hand, for 0< |θ -1|_p< |q|_p < 1, we remark that the Potts-Bethe mapping is not chaotic when p=3 and p≡ 2 (mod 3) and we could not conclude the vastness of the set of the periodic p-adic Gibbs measures. In a forthcoming paper with the same title, we will treat the case 0< |q|_p ≤ |θ -1|_p < 1 for all prime numbers p.

  17. An examination of the thermodynamics of fusion, vaporization, and sublimation of ibuprofen and naproxen by correlation gas chromatography.

    Science.gov (United States)

    Maxwell, Rachel; Chickos, James

    2012-02-01

    The vaporization enthalpies of (S)-ibuprofen and (S)-naproxen measured by correlation gas chromatography at T = 298.15 K are reported and compared with literature values. Adjustment of the fusion enthalpies of (RS)- and (S)-ibuprofen and (S)-naproxen to T = 298.15 K and combined with the vaporization enthalpy of the (S)-enantiomer of both ibuprofen and naproxen also at T = 298.15 K resulted in the sublimation enthalpies of both (S)-enantiomers. On the assumption that the vaporization enthalpy of the racemic form of ibuprofen is within the experimental uncertainty of the chiral form, the sublimation enthalpy of racemic ibuprofen was also evaluated. The vaporization and sublimation enthalpies compare favorably to the most of the literature values for the racemic form of ibuprofen but differ from the value reported for chiral ibuprofen. The literature values of (S)-naproxen are somewhat smaller than the values measured in this work. The following vaporization enthalpies were measured for (S)-ibuprofen and (S)-naproxen, respectively: ΔH(vap) (298.15 K), 106.0 ± 5.5, 132.2 ± 5.0 kJ·mol(-1) . Sublimation enthalpies of 122.7 ± 5.6 and 155.2 ± 7.1 kJ·mol(-1) were calculated for the (S)-enantiomers of ibuprofen and naproxen and a value of 128.9 ± 5.8 kJ·mol(-1) was estimated for the racemic form of ibuprofen. Copyright © 2011 Wiley Periodicals, Inc.

  18. An examination of the thermodynamics of fusion, vaporization, and sublimation of several parabens by correlation gas chromatography.

    Science.gov (United States)

    Umnahanant, Patamaporn; Chickos, James

    2011-05-01

    The vaporization, fusion, and sublimation enthalpies of methyl, ethyl, propyl, and butyl paraben are reported and compared with literature values. The vaporization enthalpies were measured by correlation gas chromatography and the fusion enthalpies by differential scanning calorimetry. Adjusted to T = 298.15 K, these enthalpies were combined to yield the sublimation enthalpy. The results compare favorably to some of the literature values but do not support the reversal in magnitude of both the vaporization and sublimation enthalpy previously reported for propyl and butyl paraben. The following fusion and vaporization enthalpies were measured for methyl through to butyl paraben, respectively: ΔH(fus) (T(fus) ) 26.3 ± 0.1 (398.6 K), 26.5 ± 0.1 (388.5 K), 27.3 ± 0.1 (368.8), and 25.9 ± 0.3 (340.7 K) kJ·mol(-1); ΔH(vap) (298.15 K) 79.5 ± 0.5, 84.0 ± 0.5, 89.7 ± 0.6, and 95.8 ± 0.6 kJ·mol(-1). The results are believed to be accurate to ± 4 kJ·mol(-1). Copyright © 2011 Wiley-Liss, Inc.

  19. Control and calculation of the titanium sublimation pumping speed and re-ionisation in the MAST neutral beam injectors

    International Nuclear Information System (INIS)

    McAdams, R.

    2015-01-01

    Highlights: • The titanium sublimation pumps for the MAST neutral beam injectors are described. • Evaporation regimes are established to give constant pumping speed for the titanium sublimation pumps. • The MCNP code is used to calculate the pumping speeds and gas profiles in the neutral beam injectors. • The gas profiles are then used to calculate the level of re-ionisation in the beamline. - Abstract: A high pumping speed is required in neutral beam injectors to minimise re-ionisation of the neutral beams. The neutral beam injectors on MAST use titanium sublimation pumps. These pumps do not have a constant pumping speed; their pumping speed depends on the gettering surface history and on both the integrated and applied gas load. In this paper we describe a method of maintaining a constant pumping speed, through different evaporation schemes, specifically suitable for operations of the MAST neutral beam injector beamlines for both short and relatively long beam pulses by measurement of the pressure in the beamline. In addition the MCNP code is then used to calculate the pumping speed and gas profile in the beamline by adjusting the input pumping speed to match the measured pressure. This allows the resulting gas profile to be used for calculation of the re-ionisation levels and an example is given

  20. Characterization of the Sublimation and Vapor Pressure of 2-(2-Nitrovinyl) Furan (G-0) Using Thermogravimetric Analysis: Effects of Complexation with Cyclodextrins.

    Science.gov (United States)

    Ruz, Vivian; González, Mirtha Mayra; Winant, Danny; Rodríguez, Zenaida; Van den Mooter, Guy

    2015-08-19

    In the present work, the sublimation of crystalline solid 2-(2-nitrovinyl) furan (G-0) in the temperature range of 35 to 60 °C (below the melting point of the drug) was studied using thermogravimetric analysis (TGA). The sublimated product was characterized using Fourier-transformed-infrared spectroscopy (FT-IR) and thin layer chromatography (TLC). The sublimation rate at each temperature was obtained using the slope of the linear regression model and followed apparent zero-order kinetics. The sublimation enthalpy from 35 to 60 °C was obtained from the Eyring equation. The Gückel method was used to estimate the sublimation rate and vapor pressure at 25 °C. Physical mixtures, kneaded and freeze-dried complexes were prepared with 2-hydroxypropyl-β-cyclodextrin (HP-β-CD) and sulfobutyl ether-β-cyclodextrin (SBE-β-CD) and analyzed using isothermal TGA at 50 °C. The complexation contributed to reducing the sublimation process. The best results were achieved using freeze-dried complexes with both cyclodextrins.

  1. The Charlie-Gibbs Fracture Zone: A Crossroads of the Atlantic Meridional Overturning Circulation

    Science.gov (United States)

    Bower, A. S.; Furey, H. H.; Xu, X.

    2016-02-01

    The Charlie-Gibbs Fracture Zone (CGFZ), a deep gap in the Mid-Atlantic Ridge at 52N, is the primary conduit for westward-flowing Iceland-Scotland Overflow Water (ISOW), which merges with Denmark Strait Overflow Water to form the Deep Western Boundary Current. The CGFZ has also been shown to "funnel" the path of the northern branch of the eastward-flowing North Atlantic Current (NAC), thereby bringing these two branches of the AMOC into close proximity. A recent two-year time series of hydrographic properties and currents from eight tall moorings across the CGFZ offers the first opportunity to investigate the NAC as a source of variability for ISOW transport. The two-year mean and standard deviation of ISOW transport was -1.7 ± 1.5 Sv, compared to -2.4 ± 3.0 Sv reported by Saunders for a 13-month period in 1988-1989. Differences in the two estimates are partly explained by limitations of the Saunders array, but more importantly reflect the strong low-frequency variability in ISOW transport through CGFZ (which includes complete reversals). Both the observations and output from a multi-decadal simulation of the North Atlantic using the Hybrid Coordinate Ocean Model (HYCOM) forced with interannually varying wind and buoyancy fields indicate a strong positive correlation between ISOW transport and the strength of the NAC through the CGFZ (stronger eastward NAC related to weaker westward ISOW transport). Vertical structure of the low-frequency current variability and water mass structure in the CGFZ will also be discussed. The results have implications regarding the interaction of the upper and lower limbs of the AMOC, and downstream propagation of ISOW transport variability in the Deep Western Boundary Current.

  2. Modeling Electric Double-Layer Capacitors Using Charge Variation Methodology in Gibbs Ensemble

    Directory of Open Access Journals (Sweden)

    Ganeshprasad Pavaskar

    2018-01-01

    Full Text Available Supercapacitors deliver higher power than batteries and find applications in grid integration and electric vehicles. Recent work by Chmiola et al. (2006 has revealed unexpected increase in the capacitance of porous carbon electrodes using ionic liquids as electrolytes. The work has generated curiosity among both experimentalists and theoreticians. Here, we have performed molecular simulations using a recently developed technique (Punnathanam, 2014 for simulating supercapacitor system. In this technique, the two electrodes (containing electrolyte in slit pore are simulated in two different boxes using the Gibbs ensemble methodology. This reduces the number of particles required and interfacial interactions, which helps in reducing computational load. The method simulates an electric double-layer capacitor (EDLC with macroscopic electrodes with much smaller system sizes. In addition, the charges on individual electrode atoms are allowed to vary in response to movement of electrolyte ions (i.e., electrode is polarizable while ensuring these atoms are at the same electric potential. We also present the application of our technique on EDLCs with the electrodes modeled as slit pores and as complex three-dimensional pore networks for different electrolyte geometries. The smallest pore geometry showed an increase in capacitance toward the potential of 0 charge. This is in agreement with the new understanding of the electrical double layer in regions of dense ionic packing, as noted by Kornyshev’s theoretical model (Kornyshev, 2007, which also showed a similar trend. This is not addressed by the classical Gouy–Chapman theory for the electric double layer. Furthermore, the electrode polarizability simulated in the model improved the accuracy of the calculated capacitance. However, its addition did not significantly alter the capacitance values in the voltage range considered.

  3. Modelling metal-humate interactions: an approach based on the Gibbs-Donnan concept

    International Nuclear Information System (INIS)

    Ephraim, J.H.

    1995-01-01

    Humic and fulvic acids constitute an appreciable portion of organic substances in both aquatic and terrestrial environments. Their ability to sequester metal ions and other trace elements has engaged the interest of numerous environmental scientists recently and even though considerable advances have been made, a lot more remains unknown in the area. The existence of high molecular weight fractions and functional group heterogeneity have endowed ion exchange characteristics to these substances. For example, the cation exchange capacities of some humic substances have been compared to those of smectites. Recent development in the solution chemistry has also indicated that humic substances have the capability to interact with other anions because of their amphiphilic nature. In this paper, metal-humate interaction is described by relying heavily on information obtained from treatment of the solution chemistry of ion exchangers as typical polymers. In such a treatment, the perturbations to the metal-humate interaction are estimated by resort to the Gibbs-Donnan concept where the humic substance molecule is envisaged as having a potential counter-ion concentrating region around its molecular domain into which diffusible components can enter or leave depending on their corresponding electrochemical potentials. Information from studies with ion exchangers have been adapted to describe ionic equilibria involving these substances by making it possible to characterise the configuration/conformation of these natural organic acids and to correct for electrostatic effects in the metal-humate interaction. The resultant unified physicochemical approach has facilitated the identification and estimation of the complications to the solution chemistry of humic substances. (authors). 15 refs., 1 fig

  4. AdS/QCD, Light-Front Holography, and Sublimated Gluons

    Energy Technology Data Exchange (ETDEWEB)

    Brodsky, Stanley J.; /SLAC; de Teramond, Guy F.; /Costa Rica U.

    2012-02-16

    The gauge/gravity duality leads to a simple analytical and phenomenologically compelling nonperturbative approximation to the full light-front QCD Hamiltonian - 'Light-Front Holography', which provides a Lorentz-invariant first-approximation to QCD, and successfully describes the spectroscopy of light-quark meson and baryons, their elastic and transition form factors, and other hadronic properties. The bound-state Schroedinger and Dirac equations of the soft-wall AdS/QCD model predict linear Regge trajectories which have the same slope in orbital angular momentum L and radial quantum number n for both mesons and baryons. Light-front holography connects the fifth-dimensional coordinate of AdS space z to an invariant impact separation variable {zeta} in 3+1 space at fixed light-front time. A key feature is the determination of the frame-independent light-front wavefunctions of hadrons - the relativistic analogs of the Schroedinger wavefunctions of atomic physics which allow one to compute form factors, transversity distributions, spin properties of the valence quarks, jet hadronization, and other hadronic observables. One thus obtains a one-parameter color-confining model for hadron physics at the amplitude level. AdS/QCD also predicts the form of the non-perturbative effective coupling {alpha}{sub s}{sup AdS} (Q) and its {beta}-function with an infrared fixed point which agrees with the effective coupling a{sub g1} (Q{sup 2}) extracted from measurements of the Bjorken sum rule below Q{sup 2} < 1 GeV{sup 2}. This is consistent with a flux-tube interpretation of QCD where soft gluons with virtualities Q{sup 2} < 1 GeV{sup 2} are sublimated into a color-confining potential for quarks. We discuss a number of phenomenological hadronic properties which support this picture.

  5. Spectroscopic, microscopic, and internal stress analysis in cadmium telluride grown by close-space sublimation

    International Nuclear Information System (INIS)

    Manciu, Felicia S.; Salazar, Jessica G.; Diaz, Aryzbe; Quinones, Stella A.

    2015-01-01

    High quality materials with excellent ordered structure are needed for developing photovoltaic and infrared devices. With this end in mind, the results of our research prove the importance of a detailed, comprehensive spectroscopic and microscopic analysis in assessing cadmium telluride (CdTe) characteristics. The goal of this work is to examine not only material crystallinity and morphology, but also induced stress in the deposit material. A uniform, selective growth of polycrystalline CdTe by close-space sublimation on patterned Si(111) and Si(211) substrates is demonstrated by scanning electron microscopy images. Besides good crystallinity of the samples, as revealed by both Raman scattering and Fourier transform infrared absorption investigations, the far-infrared transmission data also show the presence of surface optical phonon modes, which is direct evidence of confinement in such a material. The qualitative identification of the induced stress was achieved by performing confocal Raman mapping microscopy on sample surfaces and by monitoring the existence of the rock-salt and zinc-blende structural phases of CdTe, which were associated with strained and unstrained morphologies, respectively. Although the induced stress in the material is still largely due to the high lattice mismatch between CdTe and the Si substrate, the current results provide a direct visualization of its partial release through the relaxation effect at crystallite boundaries and of preferential growth directions of less strain. Our study, thus offers significant value for improvement of material properties, by targeting the needed adjustments in the growth processes. - Highlights: • Assessing the characteristics of CdTe deposited on patterned Si substrates • Proving the utility of confocal Raman microscopy in monitoring the induced stress • Confirming the partial stress release through the grain boundary relaxation effect • Demonstrating the phonon confinement effect in low

  6. Analyses of hypothetical nuclear criticality excursions in 10- and 20-MW freezer/sublimer vessels

    International Nuclear Information System (INIS)

    Haught, C.F.; Jordan, W.C.; Basoglu, B.; Dodds, H.L.; Wilkinson, A.D.

    1995-01-01

    A theoretical model is used to predict the consequences of a postulated hypothetical nuclear criticality excursion in a freezer/sublimer (F/S). Previous work has shown that an intrusion of water into a F/S may result in a critical configuration. A first attempt is made to model the neutronic and thermal-hydraulic phenomena occurring during a criticality excursion involving both uranium hexafluoride (UF 6 ) and uranyl fluoride (UO 2 F 2 ) solution, which is present in the F/S during upset conditions. The model employs point neutronics coupled with simple thermal hydraulics. Reactivity feedback from changes in the properties of the system are included in the model. The excursion is studied in a 10-MW F/S with an initial load of 3,500 kg of 5% weight enriched UF 6 and in a 20-MW F/S with an initial load of 6,800 kg of 2% weight enriched UF 6 . The magnitude of the fission release determined in this work is 5.93 x 10 18 fissions in the 10-MW F/S and 4.21 x 10 18 fissions in the 20-MW F/S. In order to demonstrate the reliability of the techniques used in this work, a limited validation study was conducted by comparing the fission release and peak fission rate determined by this work with experimental results for a limited number of experiments. The agreement between calculations and experiments in the validation study is considered to be satisfactory. The calculational results for the hypothetical accidents in the two F/S vessels appear reasonable

  7. Theoretical Understanding the Relations of Melting-point Determination Methods from Gibbs Thermodynamic Surface and Applications on Melting Curves of Lower Mantle Minerals

    Science.gov (United States)

    Yin, K.; Belonoshko, A. B.; Zhou, H.; Lu, X.

    2016-12-01

    The melting temperatures of materials in the interior of the Earth has significant implications in many areas of geophysics. The direct calculations of the melting point by atomic simulations would face substantial hysteresis problem. To overcome the hysteresis encountered in the atomic simulations there are a few different melting-point determination methods available nowadays, which are founded independently, such as the free energy method, the two-phase or coexistence method, and the Z method, etc. In this study, we provide a theoretical understanding the relations of these methods from a geometrical perspective based on a quantitative construction of the volume-entropy-energy thermodynamic surface, a model first proposed by J. Willard Gibbs in 1873. Then combining with an experimental data and/or a previous melting-point determination method, we apply this model to derive the high-pressure melting curves for several lower mantle minerals with less computational efforts relative to using previous methods only. Through this way, some polyatomic minerals at extreme pressures which are almost unsolvable before are calculated fully from first principles now.

  8. A development of the Gibbs potential of a quantised system made up of a large number of particles. III. The contribution of binary collisions

    International Nuclear Information System (INIS)

    BLOCH, Claude; DE DOMINICIS, Cyrano

    1959-01-01

    Starting from an expansion derived in a previous work, we study the contribution to the Gibbs potential of the two-body dynamical correlations, taking into account the statistical correlations. Such a contribution is of interest for low-density systems at low temperature. In the zero density limit, it reduces to the Beth-Uhlenbeck expression for the second virial coefficient. For a system of fermions in the zero temperature limit, it yields the contribution of the Brueckner reaction matrix to the ground state energy, plus, under certain conditions, additional terms of the form exp ( β / Δ /), where the Δ are the binding energies of 'bound states' of the type first discussed by L. Cooper. Finally, we study the wave function of two particles immersed in a medium (defined by its temperature and chemical potential). It satisfies an equation generalizing the Bethe-Goldstone equation for an arbitrary temperature. Reprint of a paper published in Nuclear Physics, 10, p. 509-526, 1959

  9. Accurate and precise determination of critical properties from Gibbs ensemble Monte Carlo simulations

    International Nuclear Information System (INIS)

    Dinpajooh, Mohammadhasan; Bai, Peng; Allan, Douglas A.; Siepmann, J. Ilja

    2015-01-01

    Since the seminal paper by Panagiotopoulos [Mol. Phys. 61, 813 (1997)], the Gibbs ensemble Monte Carlo (GEMC) method has been the most popular particle-based simulation approach for the computation of vapor–liquid phase equilibria. However, the validity of GEMC simulations in the near-critical region has been questioned because rigorous finite-size scaling approaches cannot be applied to simulations with fluctuating volume. Valleau [Mol. Simul. 29, 627 (2003)] has argued that GEMC simulations would lead to a spurious overestimation of the critical temperature. More recently, Patel et al. [J. Chem. Phys. 134, 024101 (2011)] opined that the use of analytical tail corrections would be problematic in the near-critical region. To address these issues, we perform extensive GEMC simulations for Lennard-Jones particles in the near-critical region varying the system size, the overall system density, and the cutoff distance. For a system with N = 5500 particles, potential truncation at 8σ and analytical tail corrections, an extrapolation of GEMC simulation data at temperatures in the range from 1.27 to 1.305 yields T c = 1.3128 ± 0.0016, ρ c = 0.316 ± 0.004, and p c = 0.1274 ± 0.0013 in excellent agreement with the thermodynamic limit determined by Potoff and Panagiotopoulos [J. Chem. Phys. 109, 10914 (1998)] using grand canonical Monte Carlo simulations and finite-size scaling. Critical properties estimated using GEMC simulations with different overall system densities (0.296 ≤ ρ t ≤ 0.336) agree to within the statistical uncertainties. For simulations with tail corrections, data obtained using r cut = 3.5σ yield T c and p c that are higher by 0.2% and 1.4% than simulations with r cut = 5 and 8σ but still with overlapping 95% confidence intervals. In contrast, GEMC simulations with a truncated and shifted potential show that r cut = 8σ is insufficient to obtain accurate results. Additional GEMC simulations for hard-core square-well particles with various

  10. Paleocurrents in the Charlie-Gibbs Fracture Zone during the Late Quaternary

    Science.gov (United States)

    Bashirova, L. D.; Dorokhova, E.; Sivkov, V.; Andersen, N.; Kuleshova, L. A.; Matul, A.

    2017-12-01

    The sedimentary processes prevailing in the Charlie-Gibbs Fracture Zone (CGFZ) are gravity flows. They rework pelagic sediments and contourites, and hereby mask the paleoceanographic information partly. The aim of this work is to study sediments of the AMK-4515 core taken in eastern part of the CGFZ. The sediment core AMK-4515 (52°03.14" N, 29°00.12" W; 370 cm length, water depth 3590 m) is located in the southern valley of the CGFZ. This natural deep corridor is influenced by both the westward Iceland-Scotland Overflow Water and underlying counterflow from the Newfoundland Basin. An alternation of the calcareous silty clays and hemipelagic clayey muds in the studied section indicates similarity between our core and long cores taking from CGFZ. A sharp facies shift was found at 80 cm depth in the investigated core. Only the upper section (0-80 cm) is valid for paleoreconstruction. Planktonic foraminiferal distribution and sea-surface temperature (SST) derived from these allow for tracing the PF and NAC latitudinal migrations during investigated period. So-called sortable silt mean size (SS) was used as proxy for reconstruction of bottom current intensity. The age model is based on δ18O and AMS 14C dating, as well as ice-rafted debris (IRD) counts and CaCO3 content. Stratigraphic subdivision of this section allows to allocate 2 marine isotope stages (MIS) covering the last 27 ka. We refer sediments below this level (80-370 cm) to upper part of turbidite, which was formed as a result of massive slide in the southern channel of the CGFZ. Sandy particles were deposited first, underlying silts and clays. This short-term event occurred so quickly that pelagic sedimentation played no role and was not reflected in the grain size distributions. There is evidence for the significant role of gravity flows in sedimentation in the southern channel of the CGFZ. According to our data, the massive sediment slide occurred in the CGFZ about 27 ka. The authors are grateful to RSF

  11. Determination of molar enthalpy of sublimation in case of orotic acid as obtained from experimental and computational data

    Science.gov (United States)

    Marochkin, Ilya I.; Altova, Ekaterina P.; Chilingarov, Norbert S.; Vilkova, Anna L.; Shishkov, Igor F.

    2018-03-01

    Saturated vapor pressure, ln(p/Pa) = (-21316 ± 511)/(T/K)+(41.64 ± 0.11), and enthalpy of sublimation of orotic acid, Δsub Hm0 (Tm) = 177 ± 4 kJ/mol, were determined by means of Knudsen effusion mass spectrometry in the temperature range of 423÷493 K. The computational approaches supported the experimental results reported. The theoretical estimation of the gas-phase enthalpy of formation for orotic acid was done with different working reactions used.

  12. On adequacy of reference sample composition to metal oxide composition in spectral analysis by the method of sublimating additions

    International Nuclear Information System (INIS)

    Zakhariya, N.F.; Turulina, O.P.

    1983-01-01

    The problem on adequacy of zirconium dioxide reference samples to analysed samples is considered. The mechanism of impurities evaporation process in the presence of the sublimating addition for elements of different nature is studied and limiting it stages have been found. It is shown that kinetic probability of impurities transfer into the form of more high-volatile compounds depending on conditions of preparing zirconium dioxide samples may not coincide with the thermodynamic one. With this connected are systematic deviations of the analytical signal value for samples of different technological prehistory

  13. On the temperature dependence of the Adam-Gibbs equation around the crossover region in the glass transition

    Science.gov (United States)

    Duque, Michel; Andraca, Adriana; Goldstein, Patricia; del Castillo, Luis Felipe

    2018-04-01

    The Adam-Gibbs equation has been used for more than five decades, and still a question remains unanswered on the temperature dependence of the chemical potential it includes. Nowadays, it is a well-known fact that in fragile glass formers, actually the behavior of the system depends on the temperature region it is being studied. Transport coefficients change due to the appearance of heterogeneity in the liquid as it is supercooled. Using the different forms for the logarithmic shift factor and the form of the configurational entropy, we evaluate this temperature dependence and present a discussion on our results.

  14. The Relationship of Dynamical Heterogeneity to the Adam-Gibbs and Random First-Order Transition Theories of Glass Formation

    OpenAIRE

    Starr, Francis W.; Douglas, Jack F.; Sastry, Srikanth

    2013-01-01

    We carefully examine common measures of dynamical heterogeneity for a model polymer melt and test how these scales compare with those hypothesized by the Adam and Gibbs (AG) and random first-order transition (RFOT) theories of relaxation in glass-forming liquids. To this end, we first analyze clusters of highly mobile particles, the string-like collective motion of these mobile particles, and clusters of relative low mobility. We show that the time scale of the high-mobility clusters and stri...

  15. Variations in the Holocene North Atlantic Bottom Current Strength in the Charlie Gibbs Fracture Zone

    Science.gov (United States)

    Kissel, C.; Van Toer, A.; Cortijo, E.; Turon, J.

    2011-12-01

    The changes in the strength of the North Atlantic bottom current during the Holocene period is presented via the study of cores located at the western termination of the northern deep channel of the Charlie-Gibbs fracture zone. This natural roughly E-W corridor is bathed by the Iceland-Scotland overflow water (ISOW) when it passes westward out of the Iceland Basin into the western North Atlantic basin. At present, it is also described as the place where southern sourced silicate-rich Lower Deep Water (LDW) derived from the Antarctic Bottom Waters (AABW) are passing westward, mixing with the ISOW. We conducted a deep-water multiproxy analysis on two nearby cores, coupling magnetic properties, anisotropy, sortable silt and benthic foraminifera isotopes. The first core had been taken by the R. V. Charcot in 1977 and the second one is a CASQ core taken during the IMAGES-AMOCINT MD168- cruise in the framework of the 06-EuroMARC-FP-008 Project on board the R.V. Marion Dufresne (French Polar Institute, IPEV) in 2008. The radiocarbon ages indicate an average sedimentation rate of about 50 cm/kyr through middle and late Holocene allowing a data resolution ranging from 40 to 100 years depending on the proxy. In each core, we observe long-term and short-term changes in the strength of the bottom currents. On the long term, a decrease in the amount of magnetic particles (normalized by the carbonate content) is first from 10 kyr to 8.6 kyr and then between 6 and 2 kyrs before reaching a steady state. Following Kissel et al. (2009), this indicates a decrease in the ISOW strength. The mean sortable silt shows exactly the same pattern indicating that not only the intensity of the ISOW but the whole deep water mass bathing the sites has decreased. On the short term, a first very prominent event centered at about 8.4 kyr (cal. ages) is marked by a pronounced minima in magnetic content and the smaller mean sortable silt sizes. This is typical for an abrupt reduction in deep flow

  16. A centre-triggered magnesium fuelled cathodic arc thruster uses sublimation to deliver a record high specific impulse

    Science.gov (United States)

    Neumann, Patrick R. C.; Bilek, Marcela; McKenzie, David R.

    2016-08-01

    The cathodic arc is a high current, low voltage discharge that operates in vacuum and provides a stream of highly ionised plasma from a solid conducting cathode. The high ion velocities, together with the high ionisation fraction and the quasineutrality of the exhaust stream, make the cathodic arc an attractive plasma source for spacecraft propulsion applications. The specific impulse of the cathodic arc thruster is substantially increased when the emission of neutral species is reduced. Here, we demonstrate a reduction of neutral emission by exploiting sublimation in cathode spots and enhanced ionisation of the plasma in short, high-current pulses. This, combined with the enhanced directionality due to the efficient erosion profiles created by centre-triggering, substantially increases the specific impulse. We present experimentally measured specific impulses and jet power efficiencies for titanium and magnesium fuels. Our Mg fuelled source provides the highest reported specific impulse for a gridless ion thruster and is competitive with all flight rated ion thrusters. We present a model based on cathode sublimation and melting at the cathodic arc spot explaining the outstanding performance of the Mg fuelled source. A further significant advantage of an Mg-fuelled thruster is the abundance of Mg in asteroidal material and in space junk, providing an opportunity for utilising these resources in space.

  17. Martin Gibbs (1922-2006): Pioneer of (14)C research, sugar metabolism & photosynthesis; vigilant Editor-in-Chief of Plant Physiology; sage Educator; and humanistic Mentor.

    Science.gov (United States)

    Black, Clanton C

    2008-01-01

    The very personal touch of Professor Martin Gibbs as a worldwide advocate for photosynthesis and plant physiology was lost with his death in July 2006. Widely known for his engaging humorous personality and his humanitarian lifestyle, Martin Gibbs excelled as a strong international science diplomat; like a personal science family patriarch encouraging science and plant scientists around the world. Immediately after World War II he was a pioneer at the Brookhaven National Laboratory in the use of (14)C to elucidate carbon flow in metabolism and particularly carbon pathways in photosynthesis. His leadership on carbon metabolism and photosynthesis extended for four decades of working in collaboration with a host of students and colleagues. In 1962, he was selected as the Editor-in-Chief of Plant Physiology. That appointment initiated 3 decades of strong directional influences by Gibbs on plant research and photosynthesis. Plant Physiology became and remains a premier source of new knowledge about the vital and primary roles of plants in earth's environmental history and the energetics of our green-blue planet. His leadership and charismatic humanitarian character became the quintessence of excellence worldwide. Martin Gibbs was in every sense the personification of a model mentor not only for scientists but also shown in devotion to family. Here we pay tribute and honor to an exemplary humanistic mentor, Martin Gibbs.

  18. A development of the Gibbs potential of a quantised system made up of a large number of particles. III. The contribution of binary collisions; Un developpement du potentiel de Gibbs d'un systeme quantique compose d'un grand nombre de particules. III- La contribution des collisions binaires

    Energy Technology Data Exchange (ETDEWEB)

    BLOCH, Claude; DE DOMINICIS, Cyrano [Commissariat a l' energie atomique et aux energies alternatives - CEA, Centre d' etudes Nucleaires de Saclay, Gif-sur-Yvette (France)

    1959-07-01

    Starting from an expansion derived in a previous work, we study the contribution to the Gibbs potential of the two-body dynamical correlations, taking into account the statistical correlations. Such a contribution is of interest for low-density systems at low temperature. In the zero density limit, it reduces to the Beth-Uhlenbeck expression for the second virial coefficient. For a system of fermions in the zero temperature limit, it yields the contribution of the Brueckner reaction matrix to the ground state energy, plus, under certain conditions, additional terms of the form exp ( β / Δ /), where the Δ are the binding energies of 'bound states' of the type first discussed by L. Cooper. Finally, we study the wave function of two particles immersed in a medium (defined by its temperature and chemical potential). It satisfies an equation generalizing the Bethe-Goldstone equation for an arbitrary temperature. Reprint of a paper published in Nuclear Physics, 10, p. 509-526, 1959.

  19. Atomic and plasma-material interaction data for fusion. V. 7, part B. Particle induced erosion of Be, C and W in fusion plasmas. Part B: Physical sputtering and radiation-enhanced sublimation

    International Nuclear Information System (INIS)

    Eckstein, W.; Stephens, J.A.; Clark, R.E.H.; Davis, J.W.; Haasz, A.A.; Vietzke, E.; Hirooka, Y.

    2001-01-01

    The present volume of Atomic and Plasma-Material Interaction Data for Fusion is devoted to a critical review of the physical sputtering and radiation enhanced sublimation (RES) behaviour of fusion plasma-facing materials, in particular carbon, beryllium and tungsten. The present volume is intended to provide fusion reactor designers a detailed survey and parameterization of existing, critically assessed data for the chemical erosion of plasma-facing materials by particle impact. The survey and data compilation is presented for a variety of materials containing the elements C, Be and W (including dopants in carbon materials) and impacting plasma species. The dependencies of physical sputtering and RES yields on the material temperature, incident projectile energy, and incident flux are considered. The main data compilation is presented as separate data sheets indicating the material, impacting plasma species, experimental conditions, and parameterizations in terms of analytic functions

  20. Reviewing Some Crucial Concepts of Gibbs Energy in Chemical Equilibrium Using a Computer-Assisted, Guided-Problem-Solving Approach

    Science.gov (United States)

    Borge, Javier

    2015-01-01

    G, G°, [delta][subscript r]G, [delta][subscript r]G°, [delta]G, and [delta]G° are essential quantities to master the chemical equilibrium. Although the number of publications devoted to explaining these items is extremely high, it seems that they do not produce the desired effect because some articles and textbooks are still being written with…

  1. The effect of 2,2,2-trifluoroethanol on water studied by using third derivatives of Gibbs energy, G

    DEFF Research Database (Denmark)

    Ohgi, Hiroyo; Imamura, Hiroshi; Yonenaga, Kazuki

    2016-01-01

    We determined the excess partial molar enthalpy and the excess partial molar volume, HTFEE, VTFEE, of 2,2,2-trifluoroethanol (TFE) in TFE-H2O at 25.0 °C. We then evaluate the TFE-TFE interactions in terms of enthalpy and volume, HTFE-TFEE and VTFE-TFEE, graphically without resorting to any model...

  2. A field study of the geomorphic effects of sublimating CO2 blocks on dune slopes at Coral Pink Dunes, Utah.

    Science.gov (United States)

    Bourke, Mary; Nield, Jo; Diniega, Serina; Hansen, Candy; McElwaine, Jim

    2016-04-01

    The seasonal sublimation of CO2 ice is an active driver of present-day surface change on Mars. Diniega et al (2013) proposed that a discrete type of Martian gully, found on southern hemisphere dunes, were formed by the movement of CO2 seasonal ice blocks. These 'Linear Gullies' consist primarily of long (100 m - 2.5 km) grooves with near-uniform width (few-10 m wide), and typical depth of nudge it moved downslope. The dynamics of the block movement were recorded using a pair of high resolution video cameras. Geomorphological observations were noted and topographic change was quantified using a Leica P20 terrestrial laser scanner with a resolution of 0.8 mm at 10 m, and change detection limits less than 3 mm. The block run was repeated a total of 10 times and launched from the same location at the dune brink. The experiment ran for 45 minutes. The block size was reduced to (45 x 190 x 195 mm) by the end of the run series. The resultant geomorphology shows that the separate block runs occupied different tracks leading to a triangular plan form shape with a maximum width of 3.5 m. This is different from the findings in Arizona where a narrower track span was recorded (1.7m) (Bourke et al, 2016). Similar block dynamics were observed at both sites (as blocks moved straight, swiveled and bounced downslope). Distinctive pits with arcuate rims on their downslope edge were formed where blocks bounced on the surface. These pits are at an almost equidistant spacing. Despite a longer slope (16 m as opposed to 8m at Grand Falls), no depositional apron was formed. Levee development was less consistent compared to the Arizona site, but a pronounced unpaired-levee formed towards the base of the lee slope. These data show that sublimating blocks of CO2 ice leave signatures of transport paths and are capable of eroding and transporting sediment. Diniega,S. et al (2013) A new dry hypothesis for the formation of Martian linear gullies. Icarus. Vol. 225, 1, p. 526-537. Bourke, M.C. et

  3. The role of oxygen in CdS/CdTe solar cells deposited by close-spaced sublimation

    Energy Technology Data Exchange (ETDEWEB)

    Rose, D.H.; Levi, D.H.; Matson, R.J. [National Renewable Energy Lab., Golden, CO (United States)] [and others

    1996-05-01

    The presence of oxygen during close-spaced sublimation (CSS) of CdTe has been previously reported to be essential for high-efficiency CdS/CdTe solar cells because it increases the acceptor density in the absorber. The authors find that the presence of oxygen during CSS increases the nucleation site density of CdTe, thus decreasing pinhole density and grain size. Photoluminescence showed that oxygen decreases material quality in the bulk of the CdTe film, but positively impacts the critical CdS/CdTe interface. Through device characterization the authors were unable to verify an increase in acceptor density with increased oxygen. These results, along with the achievement of high-efficiency cells (13% AM1.5) without the use of oxygen, led the authors to conclude that the use of oxygen during CSS deposition of CdTe can be useful but is not essential.

  4. Variación de la energía libre de Gibbs de la caolinita en función de la cristalinidad y tamaño de partícula

    Directory of Open Access Journals (Sweden)

    La Iglesia, A.

    1989-12-01

    Full Text Available The effect of grinding on crystallinity, particle size and solubility of two samples of kaolinite was studied. The standard Gibbs free energies of formation of different ground samples were calculated from solubility measurements, and show a direct relationship between Gibbs free energy and particle size-crystallinity variation. Values of -3752.2 and -3776.4 KJ/mol. were determinated for ΔGºl (am and ΔGºl (crys of kaolinite, respectively. A new thermodinamic equation that relates ΔGºl to particle size is proposed. This equation can probably be extended to clay mineals.Se estudia el efecto de la molienda prolongada sobre la cristalinidad, tamaño de partícula y solubilidad de dos muestras de caolinita. Se ha calculado la energía libre estandar de formación del mineral a partir de medidas de solubilidad, encontrando una relación directa entre ΔGºl, y las variaciones de tamaño de partícula y cristalinidad de las muestras. Por extrapolación, se han obtenido los valores de -3752,0 y -3776,4 KJ/mol. para ΔGºl caolinita amorfa y cristalina. Se propone una ecuación termodinámica que relaciona ΔGºl y el tamaño de partícula de la caolinita; esta ecuación puede aplicarse también a otros minerales de la arcilla.

  5. Enthalpies of solution, enthalpies of fusion and enthalpies of solvation of polyaromatic hydrocarbons: Instruments for determination of sublimation enthalpy at 298.15 K

    Energy Technology Data Exchange (ETDEWEB)

    Solomonov, Boris N., E-mail: boris.solomonov@ksu.ru; Varfolomeev, Mikhail A.; Nagrimanov, Ruslan N.; Mukhametzyanov, Timur A.; Novikov, Vladimir B.

    2015-12-20

    Graphical abstract: - Highlights: • Solution enthalpies of aromatic hydrocarbons were measured at 298.15 K. • Solution enthalpy of aromatic hydrocarbons in benzene is equal to their fusion enthalpy. • Method for calculation of solvation enthalpy of aromatic hydrocarbons was proposed. • Approach for estimation of aromatic hydrocarbons sublimation enthalpy was developed. • Obtained sublimation enthalpies coincide well with the recommended literature data. - Abstract: In this work a simple method for calculation of solvation enthalpies of polyaromatic hydrocarbons (PAHs) in various solvents at 298.15 K was proposed. According to this method the enthalpy of solvation of any polyaromatic hydrocarbon in a particular solvent can be calculated on the basis of the general formula of the compound, the solvation enthalpy of benzene in the same solvent and parameter related to the contribution of hydrogen atom into solvation enthalpy. The validity of the proposed method was confirmed by the comparison of calculated and experimentally measured values of solvation enthalpies of PAHs in benzene, tetrahydrofuran and acetonitrile. This method was used for determination of the sublimation enthalpy of PAHs at 298.15 K based on the general relationship between the enthalpy of sublimation/vaporization of the compound of interest and its enthalpies of solution and solvation in the same solvent at 298.15 K. Enthalpies of solution at infinite dilution of several PAHs were measured in acetonitrile, benzene and tetrahydrofuran at 298.15 K. It was shown that solution enthalpies of PAHs in benzene at 298.15 K are approximately equal to their fusion enthalpies at the melting temperature. Solvation enthalpies of 15 PAHs at 298.15 K calculated according to the proposed method together with corresponding fusion enthalpy values (at the melting temperature) were used to calculate the sublimation enthalpy values at 298.15 K. Comparison of the obtained results with recommended values of

  6. About the choice of Gibbs' potential for modelling of FCC ↔ HCP transformation in FeMnSi-based shape memory alloys

    Science.gov (United States)

    Evard, Margarita E.; Volkov, Aleksandr E.; Belyaev, Fedor S.; Ignatova, Anna D.

    2018-05-01

    The choice of Gibbs' potential for microstructural modeling of FCC ↔ HCP martensitic transformation in FeMn-based shape memory alloys is discussed. Threefold symmetry of the HCP phase is taken into account on specifying internal variables characterizing volume fractions of martensite variants. Constraints imposed on model constants by thermodynamic equilibrium conditions are formulated.

  7. Estimação de parâmetros genéticos em suínos usando Amostrador de Gibbs Estimation of genetic parameters for growth and backfat thickness of Large White pigs using the Gibbs Sampler

    Directory of Open Access Journals (Sweden)

    Leandro Barbosa

    2008-07-01

    Full Text Available Um total de 38.865 registros de animais da raça Large White foi usado para estimar componentes de co-variância e parâmetros genéticos das características idade ao atingir 100 kg de peso vivo (IDA e espessura de toucinho ajustada para 100 kg de peso vivo (ET, em análises bicaracterísticas. Para obtenção dos componentes de co-variância, foi utilizado o Amostrador de Gibbs por meio do programa MTGSAM. O modelo misto utilizado continha efeito fixo de grupo contemporâneo e os seguintes efeitos aleatórios: efeito genético aditivo direto, efeito genético aditivo materno, efeito comum de leitegada e efeito residual. As médias das estimativas de herdabilidade aditivas diretas foram 0,33 e 0,44 para IDA e ET, respectivamente. As médias das estimativas do efeito comum de leitegada foram 0,09 e 0,02 para IDA e ET, respectivamente. A estimativa de correlação genética aditiva entre as características foi próxima de zero (-0,015. As herdabilidades obtidas para as características de desempenho avaliadas indicam que ganhos genéticos satisfatórios podem ser obtidos no melhoramento de suínos da raça Large White para essas características e que a seleção simultânea para ambas as características pode ser realizada, uma vez que é baixa a correlação genética aditiva direta.Data consisting of 38,865 records of Large White pigs were used to estimate genetic parameters for days to 100 kg (DAYS and backfat thickness adjusted to 100 kg (BF. Covariance components were estimated by a bivariate mixed model including the fixed effect of contemporary group and the direct and maternal additive genetic, common litter and residual random effects using the Gibbs Sampling algorithm of the MTGSAM program. Estimates of direct and common litter effects for DAYS and BF were 0.33 and 0.44 and 0.09 and 0.02, respectively. Additive genetic correlation between DAYS and BF was close to zero (-0.015. The heritability estimates indicate that genetic gains may

  8. A Short Essay on the Uses of Free Energy

    Science.gov (United States)

    Koutandos, Spyridon

    2013-01-01

    In this article we examine cases of more classical and less classical nature compared to results found by quantum mechanics and attribute a form of Free Energy discontinuity for each case within a boundary layer. The concept of a boundary layer is broadened as to include areas of first or second variations of the Gibbs free energy. It is…

  9. Energy

    International Nuclear Information System (INIS)

    Meister, F.; Ott, F.

    2002-01-01

    This chapter gives an overview of the current energy economy in Austria. The Austrian political aims of sustainable development and climate protection imply a reorientation of the Austrian energy policy as a whole. Energy consumption trends (1993-1998), final energy consumption by energy carrier (indexed data 1993-1999), comparative analysis of useful energy demand (1993 and 1999) and final energy consumption of renewable energy sources by sector (1996-1999) in Austria are given. The necessary measures to be taken in order to reduce the energy demand and increased the use of renewable energy are briefly mentioned. Figs. 5. (nevyjel)

  10. Energy

    International Nuclear Information System (INIS)

    Meister, F.

    2001-01-01

    This chapter of the environmental control report deals with the environmental impact of energy production, energy conversion, atomic energy and renewable energy. The development of the energy consumption in Austria for the years 1993 to 1999 is given for the different energy types. The development of the use of renewable energy sources in Austria is given, different domestic heat-systems are compared, life cycles and environmental balance are outlined. (a.n.)

  11. Sublimation pit distribution indicates convection cell surface velocities of ∼10 cm per year in Sputnik Planitia, Pluto

    Science.gov (United States)

    Buhler, Peter B.; Ingersoll, Andrew P.

    2018-01-01

    The ∼106 km2 Sputnik Planitia, Pluto is the upper surface of a vast basin of nitrogen ice. Cellular landforms in Sputnik Planitia with areas in the range of a few × 102-103 km2 are likely the surface manifestation of convective overturn in the nitrogen ice. The cells have sublimation pits on them, with smaller pits near their centers and larger pits near their edges. We map pits on seven cells and find that the pit radii increase by between 2.1 ± 0.4 × 10-3 and 5.9 ± 0.8 × 10-3 m m-1 away from the cell center, depending on the cell. This is a lower bound on the size increase because of the finite resolution of the data. Accounting for resolution yields upper bounds on the size vs. distance distribution of between 4.2 ± 0.2 × 10-3 and 23.4 ± 1.5 × 10-3 m m-1. We then use an analytic model to calculate that pit radii grow via sublimation at a rate of 3.6-0.6+2.1 ×10-4 m yr-1, which allows us to convert the pit size vs. distance distribution into a pit age vs. distance distribution. This yields surface velocities between 1.5-0.2+1.0 and 6.2-1.4+3.4 cm yr-1 for the slowest cell and surface velocities between 8.1-1.0+5.5 and 17.9-5.1+8.9 cm yr-1 for the fastest cell. These convection rates imply that the surface ages at the edge of cells reach ∼4.2-8.9 × 105 yr. The rates are comparable to rates of ∼6 cm yr-1 that were previously obtained from modeling of the convective overturn in Sputnik Planitia (McKinnon et al., 2016). Finally, we investigate the surface rheology of the convection cells and estimate that the minimum ice viscosity necessary to support the geometry of the observed pits is of order 1016-1017 Pa s, based on the argument that pits would relax away before growing to their observed radii of several hundred meters if the viscosity were lower than this value.

  12. The Negative Sublime in Coleridge’s Later Poetry; The Irreducibility of Difference

    Directory of Open Access Journals (Sweden)

    Nurten Birlik

    2014-01-01

    Full Text Available Abstract The poetic persona cannot form “a fair luminous light” embracing the Earth, that is, he cannot activate his creative energy. In Coleridge's other poems what triggers this energy is Joy and then the mystical power of nature. In this poem his imagination is imprisoned in his consciousness as he cannot feel Joy and the mystical power of nature cannot reconcile the binary oppositions. In his earlier poems nature was a book waiting to be deciphered and Coleridge could read the symbolic language of nature, whereas now, in the absence of Joy, this language is no more accessible to Coleridge and he thematizes the anxiety of this impasse in the poem. As a result, he cannot read the symbols that would make nature into Nature. In other words, he can perceive nature only as empirical reality and cannot perceive what lies beyond or within. This impasse is at the same time a re-formation of the rupture between subject and object that he managed to annihilate in his earlier poems.

  13. Vaporization, fusion and sublimation enthalpies of the dicarboxylic acids from C4 to C14 and C16

    International Nuclear Information System (INIS)

    Roux, Maria Victoria; Temprado, Manuel; Chickos, James S.

    2005-01-01

    The fusion enthalpies of the series butanedioic acid through to tetradecanedioic acid and hexadecanedioic acids have been measured by DSC. In addition to fusion, a number of solid-solid phase transitions have also been detected in these diacids. The vaporization enthalpies of these compounds have been measured by correlation gas chromatography using the vaporization enthalpies of butanedioic, hexanedioic and decanedioic acids as standards. The vaporization enthalpies of the diacids from C 4 to C 10 correlated linearly with the number of methylene groups present. Above C 10 , the vaporization enthalpies of C 11 -C 14 and C 16 begin to deviate from linearity. The vaporization enthalpies for these compounds are dependent on the temperature of the GC column used. Similar departure from linearity has also been observed previously in the sublimation enthalpies for these compounds. The results are discussed in terms of formation of a cyclic intramolecular hydrogen bonded network in the gas phase similar to the bimolecular association observed in smaller mono-carboxylic acids at ambient temperatures

  14. Preparation, structural and luminescent properties of nanocrystalline ZnO films doped Ag by close space sublimation method

    Science.gov (United States)

    Khomchenko, Viktoriya; Mazin, Mikhail; Sopinskyy, Mykola; Lytvyn, Oksana; Dan'ko, Viktor; Piryatinskii, Yurii; Demydiuk, Pavlo

    2018-05-01

    The simple way for silver doping of ZnO films is presented. The ZnO films were prepared by reactive rf-magnetron sputtering on silicon and sapphire substrates. Ag doping is carried out by sublimation of the Ag source located at close space at atmospheric pressure in air. Then the ZnO and ZnO-Ag films were annealed in wet media. The microstructure and optical properties of the films were compared and studied by atomic force microscopy (AFM), X-ray diffraction (XRD), photoluminescence (PL) and cathodoluminescence (CL). XRD results indicated that all the ZnO films have a polycrystalline hexagonal structure and a preferred orientation with the c-axis perpendicular to the substrate. The annealing and Ag doping promote increasing grain's sizes and modification of grain size distribution. The effect of substrate temperature, substrate type, Ag doping and post-growth annealing of the films was studied by PL spectroscopy. The effect of Ag doping was obvious and identical for all the films, namely the wide visible bands of PL spectra are suppressed by Ag doping. The intensity of ultraviolet band increased 15 times as compared to their reference films on sapphire substrate. The ultraviolet/visible emission ratio was 20. The full width at half maximum (FWHM) for a 380 nm band was 14 nm, which is comparable with that of epitaxial ZnO. The data implies the high quality of ZnO-Ag films. Possible mechanisms to enhance UV emission are discussed.

  15. Plasma assisted growth of MoO{sub 3} films on different substrate locations relative to sublimation source

    Energy Technology Data Exchange (ETDEWEB)

    Sharma, Rabindar K., E-mail: rkrksharma6@gmail.com; Saini, Sujit K.; Kumar, Prabhat; Singh, Megha; Reddy, G. B. [Thin film laboratory, Department of Physics, Indian Institute of Technology Delhi, New Delhi – 110016 (India)

    2016-05-06

    In the present paper, we reported the role of substrate locations relative to source on the growth of MoO{sub 3} films deposited on Ni coated glass substrates using plasma assisted sublimation process (PASP). According to the XRD and SEM results, substrate location is very crucial factor to control the morphology of MoO{sub 3} films and the best nanostructure growth (in terms of alignments and features) is obtained in case of Sample B (in which substrate is placed on source). The structural results point out that all films exhibit only orthorhombic phase of molybdenum oxide (i.e. α-MoO{sub 3})but the most preferential growth is recorded in Sample B due to the presence of intense peaks crossponding to only (0 k 0) family of crystal planes (k = 2, 4,6..). The Raman analysis again confirms the orthorhombic nature of MoO{sub 3} NFs and details of vibrational bondsin Sample B have been given in the present report. The MoO{sub 3} NFs show intense PL emission in wavelength range of 300-700 nm with three peaks located at 415, 490, and 523 nm in accordance to the improved crystallinity in Sample B.

  16. Sublimation Properties of Pentaerythritol Tetranitrate Single Crystals Doped with Its Homologs

    Energy Technology Data Exchange (ETDEWEB)

    Bhattacharia, Sanjoy K.; Maiti, Amitesh; Gee, Richard H.; Weeks, Brandon L.

    2012-07-20

    Pentaerythritol tetranitrate (PETN) is a secondary explosive used extensively in military and commercial applications. Coarsening of PETN during long-term storage changes the physical properties such as surface area and particle morphology which are important factors in initiation and performance. Doping of impurities was proposed to slow the coarsening process since impurities were shown to modify both the kinetic and thermodynamic properties. In this paper, we discuss how doping of PETN with its homologs of dipentaerythritol hexanitrate (diPEHN) and tripentaerytritol octanitrate (triPEON) affect kinetic and thermodynamic parameters. Pure and homolog doped PETN single crystals were prepared by solvent evaporation in acetone at room temperature. Doping concentrations for this study were 1000 ppm, 5000 ppm, and 10000 ppm. Activation energy and vapor pressure of pure and doped PETN single crystals were obtained from thermogravimetric analysis data.

  17. Energy

    International Nuclear Information System (INIS)

    Bobin, J.L.

    1996-01-01

    Object of sciences and technologies, energy plays a major part in economics and relations between nations. Jean-Louis Bobin, physicist, analyses the relations between man and energy and wonders about fears that delivers nowadays technologies bound to nuclear energy and about the fear of a possible shortage of energy resources. (N.C.). 17 refs., 14 figs., 2 tabs

  18. Energy

    CERN Document Server

    Foland, Andrew Dean

    2007-01-01

    Energy is the central concept of physics. Unable to be created or destroyed but transformable from one form to another, energy ultimately determines what is and isn''t possible in our universe. This book gives readers an appreciation for the limits of energy and the quantities of energy in the world around them. This fascinating book explores the major forms of energy: kinetic, potential, electrical, chemical, thermal, and nuclear.

  19. Study of a micro-sublimation apparatus with removal of the vapours by pumping; application to the analysis of fluorinated products (1963)

    International Nuclear Information System (INIS)

    Delvalle, P.

    1963-01-01

    Micro-sublimation analysis presents definite advantages both from the qualitative and quantitative points of view. An automatic micro-sublimation analysis apparatus has been developed for the analysis of fluorinated products (ClF 3 , HF, UF 6 , etc.) but this is only one particular application of a method which has a far wider field of possible applications. We give first the most favorable conditions for the operation of such an apparatus. These conditions are the use of a detector which is linear and independent of the nature of the gas, the flow of the sublimed vapours in the conditions of molecular flow, and finally a reproducible and linear re-heating of the separating trap. The apparatus thus built has the advantage of yielding any analysis without prior calibration. It also makes possible the easy identification of an unknown product by the determination of its vapour pressure curve and its molecular weight. The analysis of fluorinated products with this apparatus has shown that the experimental results agree well with what is expected. (author) [fr

  20. Ülev ei Kivisildniku luules. Üks lugemisviis. The Sublime „No” in Kivisildnik’s Poetry: A Way of Reading

    Directory of Open Access Journals (Sweden)

    Leo Luks

    2012-04-01

    Full Text Available This article aims toward a phenomenological interpretation of the unmediated experience of reading Sven Kivisildnik’s poetry. As the basic theoretical thesis of the article, I assert that there is always an inherent negativity in the feeling of the sublime, since this feeling is caused by unrepresentable experience. Likewise, I claim that this negativity is not merely a lack in aesthetic representation, but that it has deep ontological meaning in itself. I make connections between the inherent negativity in the feeling of the sublime and the concept of failure of linguistic utterance worked out by Jaan Undusk, Jaak Tomberg and Jüri Lipping. I come to the conclusion that the „no” in the feeling of sublimity is given to us in unmediated form. The practical (or applied intention of this article is to show that the dominant sociocentric interpretation of Kivisildnik’s poetry is one-sided and limiting. From the theoretical positions I have worked out, I outline the fundamental motifs of Kivisildnik’s poetry, and by means of examples drawn from the text, demonstrate how the „no” of the sublime is found there. I come to the conclusion that the dominant direction in Kivisildnik’s poetry is destruction. The article consists of an introduction, five sections, and a summary. In the first section („Approaches”, I briefly introduce the phenomenological approach. My position is that the work is always created during the act of reading, as the outcome of the union of text and reader. However, I leave the reader as subject open to definition, leaving it to drift as it were, since I am sceptical about the possibility of defining the subject. I do not claim that the sublime is the only possible conceptual framework for understanding poetry; rather, I consider the sublime as one proper theoretical metaphor for conceptualizing personal experience of reading. In the second section of the article („Defining poetry”, I make use of Rein Raud

  1. Sublimation-assisted graphene transfer technique based on small polyaromatic hydrocarbons

    Science.gov (United States)

    Chen, Mingguang; Stekovic, Dejan; Li, Wangxiang; Arkook, Bassim; Haddon, Robert C.; Bekyarova, Elena

    2017-06-01

    Advances in the chemical vapor deposition (CVD) growth of graphene have made this material a very attractive candidate for a number of applications including transparent conductors, electronics, optoeletronics, biomedical devices and energy storage. The CVD method requires transfer of graphene on a desired substrate and this is most commonly accomplished with polymers. The removal of polymer carriers is achieved with organic solvents or thermal treatment which makes this approach inappropriate for application to plastic thin films such as polyethylene terephthalate substrates. An ultraclean graphene transfer method under mild conditions is highly desired. In this article, we report a naphthalene-assisted graphene transfer technique which provides a reliable route to residue-free transfer of graphene to both hard and flexible substrates. The quality of the transferred graphene was characterized with atomic force microscopy, scanning electron microscopy, and Raman spectroscopy. Field effect transistors, based on the naphthalene-transfered graphene, were fabricated and characterized. This work has the potential to broaden the applications of CVD graphene in fields where ultraclean graphene and mild graphene transfer conditions are required.

  2. Jovellanos en sus escritos íntimos: el paisaje y la emoción estética de lo sublime

    Directory of Open Access Journals (Sweden)

    Rueda, Ana

    2006-12-01

    Full Text Available The Diario (Diary foregrounds Jovellanos’s interest in recording Spain and its geography in a historical, statistical, economic and political sense. Like his celebrated report on political economy, the Informe sobre la ley agraria (Report on Agricultural Law, the Diario creates a moral and civil conscience that is profoundly oriented toward the social reform of Spain. Even so, the circumstance of his exile causes his gaze to acquire in this intimate work a quality unlike that of the Report. Jovellanos describes the disturbing beauty of wild landscapes and experiences in his Diary the emotional commotion that Burke (Philosophical Enquiry, 1757 and Kant (Critique of Judgment, 1790 recorded as the sublime. The pages of his Diary on which the word “sublime” and its accompanying emotions appear reveal an anxiety that threatens to undermine Jovellanos’s commitment to societal progress and the power of reason; that is, the suppositions of rational subjectivity that underlay his work as politician and writer. The concept of the sublime introduces narrative spaces of great emotion that reveal an important turn toward an epiphanic subjectivity that in successive decades would come to the fore in Romanticism. However, Jovellanos tempers his enthusiasm. On the threshold of the sublime he takes a step back. His self-alienation appears to prohibit the reader entry into zones of his private person and to frustrate the expectation of the reader of such intimate literature that he will come to know the man. And yet, it is precisely in these moments of hesitation where the reader is allowed access to the diarist´s inner struggle and to his negotiations between his private self and his social persona.El Diario recoge el interés de Jovellanos por consignar España y su geografía en un sentido histórico, estadístico, económico y político. Como hizo constar en su célebre informe de economía política aplicado al estado de la agricultura en la Espa

  3. Energy

    CERN Document Server

    Robertson, William C

    2002-01-01

    Confounded by kinetic energy? Suspect that teaching about simple machines isn t really so simple? Exasperated by electricity? If you fear the study of energy is beyond you, this entertaining book will do more than introduce you to the topic. It will help you actually understand it. At the book s heart are easy-to-grasp explanations of energy basics work, kinetic energy, potential energy, and the transformation of energy and energy as it relates to simple machines, heat energy, temperature, and heat transfer. Irreverent author Bill Robertson suggests activities that bring the basic concepts of energy to life with common household objects. Each chapter ends with a summary and an applications section that uses practical examples such as roller coasters and home heating systems to explain energy transformations and convection cells. The final chapter brings together key concepts in an easy-to-grasp explanation of how electricity is generated. Energy is the second book in the Stop Faking It! series published by NS...

  4. A random energy model for size dependence : recurrence vs. transience

    NARCIS (Netherlands)

    Külske, Christof

    1998-01-01

    We investigate the size dependence of disordered spin models having an infinite number of Gibbs measures in the framework of a simplified 'random energy model for size dependence'. We introduce two versions (involving either independent random walks or branching processes), that can be seen as

  5. Energy

    International Nuclear Information System (INIS)

    1975-10-01

    On the occasion of the World Environment Day the Norwegian Ministry for the Environment held a conference on growth problems in energy consumption. The themes which were treated were energy conservation, hydroelectric power, the role of nuclear power, radioactive waste disposal, fossil fuel resources, ecological limits, pollution and international aspects. Nuclear energy forms the main theme of one lecture and an aspect of several others. (JIW)

  6. Energy

    OpenAIRE

    Torriti, Jacopo

    2016-01-01

    The impact of energy policy measures has been assessed with various appraisal and evaluation tools since the 1960s. Decision analysis, environmental impact assessment and strategic environmental assessment are all notable examples of progenitors of Regulatory Impact Assessment (RIA) in the assessment of energy policies, programmes and projects. This chapter provides overview of policy tools which have been historically applied to assess the impacts of energy policies, programmes and projects....

  7. Energies

    International Nuclear Information System (INIS)

    2003-01-01

    In the framework of the National Debate on the energies in a context of a sustainable development some associations for the environment organized a debate on the nuclear interest facing the renewable energies. The first part presents the nuclear energy as a possible solution to fight against the greenhouse effect and the associated problem of the wastes management. The second part gives information on the solar energy and the possibilities of heat and electric power production. A presentation of the FEE (French wind power association) on the situation and the development of the wind power in France, is also provided. (A.L.B.)

  8. Estimation of Genetic Parameters for Direct and Maternal Effects in Growth Traits of Sangsari Sheep Using Gibbs Sampling

    Directory of Open Access Journals (Sweden)

    Zohreh Yousefi

    2016-11-01

    Full Text Available Introduction Small ruminants, especially native breed types, play an important role in livelihoods of a considerable part of human population in the tropics from socio-economic aspects. Therefore, integrated attempt in terms of management and genetic improvement to enhance production is of crucial importance. Knowledge of genetic variation and co-variation among traits is required for both the design of effective sheep breeding programs and the accurate prediction of genetic progress from these programs. Body weight and growth traits are one of the economically important traits in sheep production, especially in Iran where lamb sale is the main source of income for sheep breeders while other products are in secondary importance. Although mutton is the most important source of protein in Iran, meat production from the sheep does not cover the increasing consumer demand. On the other hand, increase in sheep number to increase meat production has been limited by low quality and quantity of forage range. Therefore, enhancing meat production should be achieved by selecting the animals that have maximum genetic merit as next generation parents. To design an efficient improvement program and genetic evaluation system for maximization response to selection for economically important traits, accurate estimates of the genetic parameters and the genetic relationships between the traits are necessary. Studies of various sheep breeds have shown that both direct and maternal genetic influences are of importance for lamb growth. When growth traits are included in the breeding goal, both direct and maternal genetic effects should be taken into account in order to achieve optimum genetic progress. The objective of this study was to estimate the variance components and heritability, for growth traits, by fitting six animal models in the Sangsari sheep using Gibbs sampling. Material and Method Sangsari is a fat-tailed and relatively small sized breed of sheep

  9. The relationship of dynamical heterogeneity to the Adam-Gibbs and random first-order transition theories of glass formation.

    Science.gov (United States)

    Starr, Francis W; Douglas, Jack F; Sastry, Srikanth

    2013-03-28

    We carefully examine common measures of dynamical heterogeneity for a model polymer melt and test how these scales compare with those hypothesized by the Adam and Gibbs (AG) and random first-order transition (RFOT) theories of relaxation in glass-forming liquids. To this end, we first analyze clusters of highly mobile particles, the string-like collective motion of these mobile particles, and clusters of relative low mobility. We show that the time scale of the high-mobility clusters and strings is associated with a diffusive time scale, while the low-mobility particles' time scale relates to a structural relaxation time. The difference of the characteristic times for the high- and low-mobility particles naturally explains the well-known decoupling of diffusion and structural relaxation time scales. Despite the inherent difference of dynamics between high- and low-mobility particles, we find a high degree of similarity in the geometrical structure of these particle clusters. In particular, we show that the fractal dimensions of these clusters are consistent with those of swollen branched polymers or branched polymers with screened excluded-volume interactions, corresponding to lattice animals and percolation clusters, respectively. In contrast, the fractal dimension of the strings crosses over from that of self-avoiding walks for small strings, to simple random walks for longer, more strongly interacting, strings, corresponding to flexible polymers with screened excluded-volume interactions. We examine the appropriateness of identifying the size scales of either mobile particle clusters or strings with the size of cooperatively rearranging regions (CRR) in the AG and RFOT theories. We find that the string size appears to be the most consistent measure of CRR for both the AG and RFOT models. Identifying strings or clusters with the "mosaic" length of the RFOT model relaxes the conventional assumption that the "entropic droplets" are compact. We also confirm the

  10. On the interfacial energy of coherent interfaces

    International Nuclear Information System (INIS)

    Kaptay, G.

    2012-01-01

    A thermodynamic model has been developed for interfacial energies of coherent interfaces using only the molar Gibbs energy and the molar volume of the two phases surrounding the interface as the initial data. The analysis is started from the simplest case of the interface formed by two solutions on the two sides of a miscibility gap, when both phases are described by the same Gibbs energy and molar volume functions. This method is applied to the fcc Au–Ni, liquid Ga–Pb and liquid Al–Bi systems. Reasonable agreement was found with the measured values in liquid Ga–Pb and Al–Bi systems. It was shown that the calculated results are sensitive to the choice of the Calphad-estimated thermodynamic data. The method is extended to the case where the two phases are described by different Gibbs energy and molar volume functions. The extended model is applied to the interface present in an Ni-based superalloy between the AlNi 3 face-centered cubic (fcc) compound and the Ni–Al fcc disordered solid solution. The calculated results are found to be similar to other values recently obtained from the combination of kinetic and thermodynamic data. The method is extended to ternary and higher order systems. It is predicted that the interfacial energy will gradually decrease with the increase in number of components in the system.

  11. Impact of Wire Geometry in Energy Extraction from Salinity Differences Using Capacitive Technology

    NARCIS (Netherlands)

    Sales, B.B.; Burheim, O.S.; Liu, F.; Schaetzle, O.; Buisman, C.J.N.; Hamelers, H.V.M.

    2012-01-01

    Energy extraction based on capacitive Donnan potential (CDP) is a recently suggested technique for sustainable power generation. CDP combines the use of ion-exchange membranes and porous carbon electrodes to convert the Gibbs free energy of mixing sea and river water into electric work. The

  12. Thermodynamic, energy efficiency, and power density analysis of reverse electrodialysis power generation with natural salinity gradients

    NARCIS (Netherlands)

    Yip, N.Y.; Vermaas, D.A.; Nijmeijer, K.; Elimelech, M.

    2014-01-01

    Reverse electrodialysis (RED) can harness the Gibbs free energy of mixing when fresh river water flows into the sea for sustainable power generation. In this study, we carry out a thermodynamic and energy efficiency analysis of RED power generation, and assess the membrane power density. First, we

  13. An examination of the thermodynamics of fusion, vaporization, and sublimation of (R,S)- and (R)-flurbiprofen by correlation gas chromatography.

    Science.gov (United States)

    Umnahanant, Patamaporn; Hasty, Darrell; Chickos, James

    2012-06-01

    The vaporization, fusion, and sublimation enthalpies of (R,S)- and (R)-flurbiprofen at T = 298.15 K are reported and compared with literature values when available. Correlation gas chromatography experiments were first performed to identify appropriate standards that could be used for materials containing a single fluorine substituent. Subsequent correlations resulted in a vaporization enthalpy for (R,S)-flurbiprofen and (R)-flurbiprofen, ΔH(vap) (298.15 K), of (127.5 ± 5.5) and (127.4 ± 4.7) kJ mol, respectively. Fusion enthalpies, ΔH(fus) (387 K), of (28.2 ± and, ΔH(fus) (381 K), (22.8 ± kJ mol(-1) were also measured by differential scanning calorimetry for the racemic and chiral forms of flurbiprofen. Adjusted to T = 298.15 K and combined with the vaporization enthalpy resulted in sublimation enthalpies, ΔH(sub) (298.15 K), of (155.6 ± 5.8) and (145.1 ± 5.7) kJ mol(-1) for (R,S)- and (R)-flurbiprofen, respectively. The fusion enthalpy measured for the racemic form was in excellent agreement with the literature value, while the sublimation enthalpy varies substantially from previous work. Two weak solid-solid phase transitions were also observed for (R)-flurbiprofen at T = 353.9 K (0.30 ± 0.1) and 363.2 K (0.21 ± 0.03) kJ · mol(-1). Copyright © 2012 Wiley Periodicals, Inc.

  14. A sublimate sorbent for stir-bar sorptive extraction of aqueous endocrine disruptor pesticides for gas chromatography-electron capture detection.

    Science.gov (United States)

    Huang, Yu-Wen; Lee, Hua Kwang; Shih, Hou-Kuang; Jen, Jen-Fon

    2018-06-06

    A dumbbell-shaped magnetic stir-bar with sublimate sorbent was prepared for the stir bar sorptive extraction (SBSE) of pesticides in an aqueous sample prior to gas chromatography-micro-electron capture detection (GC-μECD). Cyclododecane (CDD) was coated onto a magnetic stir-bar surface as a sublimate sorbent, and steel balls were placed on both ends to form a dumbbell-shaped magnetic stir-bar for SBSE. Four EDC pesticides including chlorpyrifos, ethion, bromopropylate, and λ-cyhalothrin in aqueous samples were selected as model species to examine the proposed SBSE and the following desorption. The parameters studied were those affecting the extraction efficiencies including the coating (solvent for CDD and thickness), extraction (sample pH, stirring rate, time, and salting out effect), dissolution solvent volume, and the loss of CDD sublimated in air. The maximum extraction efficiency was obtained under the following conditions. The stir bar (with CDD thickness of 5.2 μm) was added into a 10 mL sample solution (at pH 7) for a 20-min extraction at 600 rpm. Then, the stir bar was gently removed from the sample solution, disassembled, and immersed into a 0.2 mL insert tube consisting of 3 μL hexane to dissolve; 1 μL was used for GC-ECD analysis. The linear ranges were 0.005-5 μg L -1 with coefficients of determination ranging from 0.9950 - 0.9994. Detection limits (based on S/N = 3) of the four EDCs were 0.4-4.5 ngL -1 with a relative standard deviation (RSD) of 2.4-6.3%, and quantitation limits (based on S/N = 5) were 1-15 ngL -1 . The relative recoveries of the spiked samples were in the range of 83.2-98.7% with RSDs of 2.1-8.4% in farm field waters. The proposed sublimation sorbent obtained excellent enrichment factors (101-834) and provided a simple, rapid, sensitive, and eco-friendly sample preparation method. Copyright © 2018 Elsevier B.V. All rights reserved.

  15. Enthalpy of sublimation/vaporization of trans-cyclohexyl-1,4-diamine and cis-cyclohexyl-1,2-diamine

    OpenAIRE

    Tomé, Luciana I. N.; Rosado, Mário T. S.; Nunes, Sandra C. C.; Maria, Teresa M. R.; Canotilho, João; Eusébio, M. Ermelinda S.

    2007-01-01

    The molar enthalpy of sublimation, , of trans-cyclohexyl-1,4-diamine and the molar enthalpy of vaporization, , of cis-cyclohexyl-1,2-diamine, at the temperature 298.15 K, were determined by calorimetry. was obtained for the trans-isomer and for the cis form. The molar enthalpy of fusion of the first compound, at T = 342.1 K, was determined by differential scanning calorimetry. The molar enthalpy of vaporization of the 1,4-isomer was estimated by combining the value of the enthalpy of sublimat...

  16. Are electrostatic potentials between regions of different chemical composition measurable? The Gibbs-Guggenheim Principle reconsidered, extended and its consequences revisited.

    Science.gov (United States)

    Pethica, Brian A

    2007-12-21

    As indicated by Gibbs and made explicit by Guggenheim, the electrical potential difference between two regions of different chemical composition cannot be measured. The Gibbs-Guggenheim Principle restricts the use of classical electrostatics in electrochemical theories as thermodynamically unsound with some few approximate exceptions, notably for dilute electrolyte solutions and concomitant low potentials where the linear limit for the exponential of the relevant Boltzmann distribution applies. The Principle invalidates the widespread use of forms of the Poisson-Boltzmann equation which do not include the non-electrostatic components of the chemical potentials of the ions. From a thermodynamic analysis of the parallel plate electrical condenser, employing only measurable electrical quantities and taking into account the chemical potentials of the components of the dielectric and their adsorption at the surfaces of the condenser plates, an experimental procedure to provide exceptions to the Principle has been proposed. This procedure is now reconsidered and rejected. No other related experimental procedures circumvent the Principle. Widely-used theoretical descriptions of electrolyte solutions, charged surfaces and colloid dispersions which neglect the Principle are briefly discussed. MD methods avoid the limitations of the Poisson-Bolzmann equation. Theoretical models which include the non-electrostatic components of the inter-ion and ion-surface interactions in solutions and colloid systems assume the additivity of dispersion and electrostatic forces. An experimental procedure to test this assumption is identified from the thermodynamics of condensers at microscopic plate separations. The available experimental data from Kelvin probe studies are preliminary, but tend against additivity. A corollary to the Gibbs-Guggenheim Principle is enunciated, and the Principle is restated that for any charged species, neither the difference in electrostatic potential nor the

  17. Enthalpy of sublimation/vaporization of trans-cyclohexyl-1,4-diamine and cis-cyclohexyl-1,2-diamine

    International Nuclear Information System (INIS)

    Tome, Luciana I.N.; Rosado, Mario T.S.; Nunes, Sandra C.C.; Maria, Teresa M.R.; Canotilho, Joao; Eusebio, M. Ermelinda S.

    2007-01-01

    The molar enthalpy of sublimation, Δ cr g H m 0 , of trans-cyclohexyl-1,4-diamine and the molar enthalpy of vaporization, Δ l g H m 0 , of cis-cyclohexyl-1,2-diamine, at the temperature 298.15 K, were determined by calorimetry. Δ cr g H m 0 (T=298.15K)=(105.0±0.8)kJ.mol -1 was obtained for the trans-isomer and Δ l g H m 0 (T=298.15K)=(62.2±1.0)kJ.mol -1 for the cis form. The molar enthalpy of fusion of the first compound, at T = 342.1 K, was determined by differential scanning calorimetry. The molar enthalpy of vaporization of the 1,4-isomer was estimated by combining the value of the enthalpy of sublimation with that of the enthalpy of fusion. The values obtained for molar standard enthalpy of vaporization and those available for the enthalpy of the diamines in the gas state were used to calculate the difference between the enthalpies of both compounds in the liquid state

  18. Gibbs Measures of Nonlinear Schrödinger Equations as Limits of Many-Body Quantum States in Dimensions {d ≤slant 3}

    Science.gov (United States)

    Fröhlich, Jürg; Knowles, Antti; Schlein, Benjamin; Sohinger, Vedran

    2017-12-01

    We prove that Gibbs measures of nonlinear Schrödinger equations arise as high-temperature limits of thermal states in many-body quantum mechanics. Our results hold for defocusing interactions in dimensions {d =1,2,3}. The many-body quantum thermal states that we consider are the grand canonical ensemble for d = 1 and an appropriate modification of the grand canonical ensemble for {d =2,3}. In dimensions d = 2, 3, the Gibbs measures are supported on singular distributions, and a renormalization of the chemical potential is necessary. On the many-body quantum side, the need for renormalization is manifested by a rapid growth of the number of particles. We relate the original many-body quantum problem to a renormalized version obtained by solving a counterterm problem. Our proof is based on ideas from field theory, using a perturbative expansion in the interaction, organized by using a diagrammatic representation, and on Borel resummation of the resulting series.

  19. Effect of self-interaction on the phase diagram of a Gibbs-like measure derived by a reversible Probabilistic Cellular Automata

    International Nuclear Information System (INIS)

    Cirillo, Emilio N.M.; Louis, Pierre-Yves; Ruszel, Wioletta M.; Spitoni, Cristian

    2014-01-01

    Cellular Automata are discrete-time dynamical systems on a spatially extended discrete space which provide paradigmatic examples of nonlinear phenomena. Their stochastic generalizations, i.e., Probabilistic Cellular Automata (PCA), are discrete time Markov chains on lattice with finite single-cell states whose distinguishing feature is the parallel character of the updating rule. We study the ground states of the Hamiltonian and the low-temperature phase diagram of the related Gibbs measure naturally associated with a class of reversible PCA, called the cross PCA. In such a model the updating rule of a cell depends indeed only on the status of the five cells forming a cross centered at the original cell itself. In particular, it depends on the value of the center spin (self-interaction). The goal of the paper is that of investigating the role played by the self-interaction parameter in connection with the ground states of the Hamiltonian and the low-temperature phase diagram of the Gibbs measure associated with this particular PCA

  20. Nonextensive statistical mechanics and high energy physics

    Directory of Open Access Journals (Sweden)

    Tsallis Constantino

    2014-04-01

    Full Text Available The use of the celebrated Boltzmann-Gibbs entropy and statistical mechanics is justified for ergodic-like systems. In contrast, complex systems typically require more powerful theories. We will provide a brief introduction to nonadditive entropies (characterized by indices like q, which, in the q → 1 limit, recovers the standard Boltzmann-Gibbs entropy and associated nonextensive statistical mechanics. We then present somerecent applications to systems such as high-energy collisions, black holes and others. In addition to that, we clarify and illustrate the neat distinction that exists between Lévy distributions and q-exponential ones, a point which occasionally causes some confusion in the literature, very particularly in the LHC literature

  1. Do grotesco ao sublime: a violência como elemento condicionante de redenção em Tarântula, de Thierry Jonquet

    Directory of Open Access Journals (Sweden)

    Márcia Mucha

    2016-12-01

    Full Text Available The following work aims to demonstrate how violence is conditioning of redemption in Tarântula (1984, by Thierry Jonquet, a novel that gained notoriety after it’s film adaptation with the title "A pele que habito", released in 2011. What is noticeable is that Vincent characters, then with another name, Ève (a woman and Richard Lafargue join the end of the narrative. Although she has been imprisoned and subjected to a drastic transformation of his body and he, on a whim of revenge, made use of his plastic medical knowledge to promote sex change in Vincent without his permission. Even with all the violence that surrounds them, they surrender to each other. From this main event and others that permeate this novel, it is possible to state that this work moves from grotesque, with the issue of violence, to sublime, with the theme of redemption.

  2. Effect of the grain sizes on the photovoltaic parameters of CdTe solar cells prepared by close space sublimation method

    International Nuclear Information System (INIS)

    Potlog, T.

    2007-01-01

    Thin Film CdS/CdTe solar cells were fabricated by Close Space Sublimation at the substrate temperature ranging from 300 degrees ± 5 degrees to 340 degrees ± degrees. The best photovoltaic parameters were achieved at substrate temperature 320 degrees and source temperature 610 degrees. The open circuit voltage and current density changes significantly with the substrate temperature and depends on the dimension of the grain sizes. Grain size is an efficiency limiting parameter for CdTe layers with large grains. The open circuit voltage and current density are the best for the cells having dimension of grains between 1.0 μm and ∼ 5.0 μm. CdS/CdTe solar cells with an efficiency of ∼ 10% were obtained. (author)

  3. Phase Transition Enthalpy Measurements of Organic and Organometallic Compounds and Ionic Liquids. Sublimation, Vaporization, and Fusion Enthalpies from 1880 to 2015. Part 2. C11-C192

    Science.gov (United States)

    Acree, William; Chickos, James S.

    2017-03-01

    The second part of this compendium concludes with a collection of phase change enthalpies of organic molecules inclusive of C11-C192 reported over the period 1880-2015. Also included are phase change enthalpies including fusion, vaporization, and sublimation enthalpies for organometallic, ionic liquids, and a few inorganic compounds. Paper I of this compendium, published separately, includes organic compounds from C1 to C10 and describes a group additivity method for evaluating solid, liquid, and gas phase heat capacities as well as temperature adjustments of phase changes. Paper II of this compendium also includes an updated version of a group additivity method for evaluating total phase change entropies which together with the fusion temperature can be useful in estimating total phase change enthalpies. Other uses include application in identifying potential substances that either form liquid or plastic crystals or exhibit additional phase changes such as undetected solid-solid transitions or behave anisotropically in the liquid state.

  4. Phase Transition Enthalpy Measurements of Organic and Organometallic Compounds. Sublimation, Vaporization and Fusion Enthalpies From 1880 to 2015. Part 1. C1 - C10

    Science.gov (United States)

    Acree, William; Chickos, James S.

    2016-09-01

    A compendium of phase change enthalpies published in 2010 is updated to include the period 1880-2015. Phase change enthalpies including fusion, vaporization, and sublimation enthalpies are included for organic, organometallic, and a few inorganic compounds. Part 1 of this compendium includes organic compounds from C1 to C10. Part 2 of this compendium, to be published separately, will include organic and organometallic compounds from C11 to C192. Sufficient data are presently available to permit thermodynamic cycles to be constructed as an independent means of evaluating the reliability of the data. Temperature adjustments of phase change enthalpies from the temperature of measurement to the standard reference temperature, T = 298.15 K, and a protocol for doing so are briefly discussed.

  5. Structural characterization of AgGaTe{sub 2} layers grown on a- and c-sapphire substrates by a closed space sublimation method

    Energy Technology Data Exchange (ETDEWEB)

    Uruno, Aya; Usui, Ayaka [Department of Electrical Engineering and Bioscience, Waseda University, 3-4-1 Okubo, Shinjuku, Tokyo 169-8555 (Japan); Kobayashi, Masakazu [Department of Electrical Engineering and Bioscience, Waseda University, 3-4-1 Okubo, Shinjuku, Tokyo 169-8555 (Japan); Kagami Memorial Research Institute for Materials Science and Technology, Waseda University, 2-8-26 Nishiwaseda, Shinjuku, Tokyo 169-0051 (Japan)

    2014-07-15

    AgGaTe{sub 2} layers were grown on a- and c-plane sapphire substrates by a closed space sublimation method with varying the source temperature. Grown films were evaluated by θ -2θ and pole figure measurements of X-ray diffraction. AgGaTe{sub 2} layers were grown to have strong preference for the (103) orientation. However, it was cleared the Ag{sub 5}Te{sub 3} was formed along with the AgGaTe{sub 2} when the layer was grown on c-plane sapphire. The orientation of the film was analyzed by using the pole figure, and resulted in AgGaTe{sub 2} without Ag{sub 5}Te{sub 3} layers could be grown on a-plane sapphire. (copyright 2014 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  6. A simple experimental arrangement for measuring the vapour pressures and sublimation enthalpies by the Knudsen effusion method: Application to DNA and RNA bases

    International Nuclear Information System (INIS)

    Barros, A.L.F. de; Medina, A.; Zappa, F.; Pereira, J.M.; Bessa, E.; Martins, M.H.P.; Coelho, L.F.S.; Wolff, W.; Castro Faria, N.V. de

    2006-01-01

    We measured the vapour pressure of several DNA and RNA bases-uracil, adenine, guanine, thymine and cytosine-in the 300-450 K range. In each case the sample mass loss rate was measured as function of temperature with a simple setup consisting of a commercial film deposition system and a homemade oven. Afterwards vapour pressure values were extracted from these data using the Knudsen effusion method. Sublimation enthalpy values, obtained from vapour pressure data by applying the Clausius-Clapeyron equation, are in very good agreement with literature values. The results suggest that crystal-based film thickness monitors may be useful in on-line cross-section measurements, monitoring the gas target thickness. They also show the viability of using this oven for producing a biomolecular gas target

  7. Enhanced performance of CdS/CdTe thin-film devices through temperature profiling techniques applied to close-spaced sublimation deposition

    Energy Technology Data Exchange (ETDEWEB)

    Xiaonan Li; Sheldon, P.; Moutinho, H.; Matson, R. [National Renewable Energy Lab., Golden, CO (United States)

    1996-05-01

    The authors describe a methodology developed and applied to the close-spaced sublimation technique for thin-film CdTe deposition. The developed temperature profiles consisted of three discrete temperature segments, which the authors called the nucleation, plugging, and annealing temperatures. They have demonstrated that these temperature profiles can be used to grow large-grain material, plug pinholes, and improve CdS/CdTe photovoltaic device performance by about 15%. The improved material and device properties have been obtained while maintaining deposition temperatures compatible with commercially available substrates. This temperature profiling technique can be easily applied to a manufacturing environment by adjusting the temperature as a function of substrate position instead of time.

  8. Reply to Comment on 'On the importance of the free energy for elasticity under pressure'

    International Nuclear Information System (INIS)

    Marcus, P M; Qiu, S L

    2004-01-01

    All criticisms by Steinle-Neumann and Cohen of the correctness of our calculations of equilibrium structure and elastic constants under pressure from the Gibbs free energy are answered and the criticisms are rejected. The difference between the free energy and the internal energy as functions of structure is described to clarify the use of the free energy. The meaning of elastic constants in a system under pressure is discussed in order to derive the basic quadratic expansion of the free energy in the strains. The coefficients in the expansion are the elastic constants under pressure and are in agreement with well-known work. We give reasons why calculations based on the Gibbs free energy are simpler and more accurate than the usual calculations based on minima of the energy at constant volume. (reply)

  9. In-Space Propulsion Engine Architecture based on Sublimation of Planetary Resources: From Exploration Robots to NEO Mitigation

    Data.gov (United States)

    National Aeronautics and Space Administration — The sources of power used for deep space probe missions are usually derived from either solar panels for electrical energy, radioisotope thermal generators for...

  10. Application of volt-chins for determination of ionic components in real and chemical Gibbs transition energies of individual ions from water in aqueous-organic solvents

    International Nuclear Information System (INIS)

    Parfenyuk, V.I.

    2007-01-01

    Thermodynamic description of separate ions (among which is I - ) in individual and mixed solvents is conducted on the basis of the volt potential difference method. Application of the presented methodology serves as one of candidates problem solving of individual ions thermodynamic characterisation in solutions. Validity of application of the volt potential difference method for the determination of ionic components in real and chemical thermodynamic properties of separate ions in solutions as well as surface potential values on the solution-gas phase interfaces is demonstrated [ru

  11. Calculation of liquid-liquid equilibrium of aqueous two-phase systems using a chemical-theory-based excess Gibbs energy model

    Directory of Open Access Journals (Sweden)

    Pessôa Filho P. A.

    2004-01-01

    Full Text Available Mixtures containing compounds that undergo hydrogen bonding show large deviations from ideal behavior. These deviations can be accounted for through chemical theory, according to which the formation of a hydrogen bond can be treated as a chemical reaction. This chemical equilibrium needs to be taken into account when applying stability criteria and carrying out phase equilibrium calculations. In this work, we illustrate the application of the stability criteria to establish the conditions under which a liquid-phase split may occur and the subsequent calculation of liquid-liquid equilibrium using a chemical-theory-modified Flory-Huggins equation to describe the non ideality of aqueous two-phase systems composed of poly(ethylene glycol and dextran. The model was found to be able to correlate ternary liquid-liquid diagrams reasonably well by simple adjustment of the polymer-polymer binary interaction parameter.

  12. Correlation between the standard Gibbs energies of an anion transfer from water to highly hydrophobic ionic liquids and to 1,2-dichloroethane

    Czech Academy of Sciences Publication Activity Database

    Langmaier, Jan; Samec, Zdeněk; Samcová, E.; Tůma, P.

    714-715, FEB 2014 (2014), s. 109-115 ISSN 1572-6657 R&D Projects: GA ČR GAP206/11/0707 Institutional support: RVO:61388955 Keywords : ionic liquid * 1,2-dichloroethane * Cyclic voltammetry Subject RIV: CG - Electrochemistry Impact factor: 2.729, year: 2014

  13. Summer energy balance and ablation of high elevation glaciers in the central Chilean Andes

    Science.gov (United States)

    Brock, Benjamin; Rivera, Andres; Burger, Flavia; Bravo, Claudio

    2014-05-01

    Glaciers of the semi-arid central Chilean Andes are an important freshwater source for the populous Central Valley region of Chile, but have been shrinking in recent decades. The surface energy balance of these glaciers is of high scientific interest as summer ablation occurs through both sublimation and melt. During the 2012-13 Austral Summer a glacio-meteorological monitoring programme was established on Olivares Alfa (3.9 km2, 4130-4800 m elevation) and Beta (8.3 km2, 3620-4850 m elevation) Glaciers and their forelands in the Upper Olivares Valley, 33°00'-33°11' S, 70°05'-70°15' W, approximately 50 km north-east of Santiago. This included complete automatic weather stations (AWSs) with sonic rangers to record surface ablation on the ablation zones of the two glaciers, and one AWS in the proglacial area of Olivares Alfa Glacier including precipitation gauge. To complement these point data, daily images of the glaciers were captured with fixed cameras in order to calculate snow cover and albedo distributions. To calculate the surface energy balance and rates of melt and sublimation, a model was developed which uses direct AWS measurements of the radiative fluxes and calculates the turbulent fluxes of sensible and latent heat using the bulk aerodynamic approach. The model also calculates the subsurface heat flux and includes a simple scheme to estimate refreezing of melt water within surface snow or ice. Meteorological data and model results for the December to May period will be presented in this paper. Model calculations match closely the cumulative ablation curve of the sonic ranger at Olivares Alfa, with a slight overestimation, and overestimate cumulative ablation recorded by the sonic ranger at Olivares Beta, possibly due, at least in part, to uncertain snow density values. Modelled cumulative ablation in the December-April period is 2.2 m water equivalent (w.e.) at Olivares Alfa (0.10 m sublimation, 2.10 m melt) and 2.34 m w.e. at Olivares Beta (0.18 m

  14. Comparative study of CdTe sources used for deposition of CdTe thin films by close spaced sublimation technique

    Directory of Open Access Journals (Sweden)

    Wagner Anacleto Pinheiro

    2006-03-01

    Full Text Available Unlike other thin film deposition techniques, close spaced sublimation (CSS requires a short source-substrate distance. The kind of source used in this technique strongly affects the control of the deposition parameters, especially the deposition rate. When depositing CdTe thin films by CSS, the most common CdTe sources are: single-crystal or polycrystalline wafers, powders, pellets or pieces, a thick CdTe film deposited onto glass or molybdenum substrate (CdTe source-plate and a sintered CdTe powder. In this work, CdTe thin films were deposited by CSS technique from different CdTe sources: particles, powder, compact powder, a paste made of CdTe and propylene glycol and source-plates (CdTe/Mo and CdTe/glass. The largest deposition rate was achieved when a paste made of CdTe and propylene glycol was used as the source. CdTe source-plates led to lower rates, probably due to the poor heat transmission, caused by the introduction of the plate substrate. The results also showed that compacting the powder the deposition rate increases due to the better thermal contact between powder particles.

  15. Deposition of polycrystalline Cd{sub 1-x}Zn{sub x} Te films on ZnTe/graphite and graphite substrates by close-spaced sublimation

    Energy Technology Data Exchange (ETDEWEB)

    Okamoto, Tamotsu; Akiba, Sho; Takahashi, Kohei; Nagatsuka, Satsuki; Kanda, Yohei [Department of Electrical and Electronic Engineering, Kisarazu National College of Technology, 2-11-1 Kiyomidai-higashi, Kisarazu, Chiba 292-0041 (Japan); Tokuda, Satoshi; Kishihara, Hiroyuki; Sato, Toshiyuki [Technology Research Laboratory, Shimadzu Corporation, 3-9-4 Hikaridai, Seika-cho, Soraku-gun, Kyoto 619-0237 (Japan)

    2014-07-15

    The effects of a ZnTe layer on the deposition of a Cd{sub 1-x}Zn{sub x}Te (CZT) layer in the initial stage of the close-spaced sublimation (CSS) deposition were investigated. The deposition rate was almost constant in the initial stage of the CdTe deposition on the ZnTe/graphite substrates. However, the deposition rate within 1 minute was lower than that after 1 minute in the CdTe deposition on graphite substrates. This result suggests that nucleation of CdTe directly deposited on graphite substrate is difficult when compared to that with a ZnTe layer. Furthermore, the effects of CdCl{sub 2} and ZnTe additions to the CdTe sources in the CSS deposition were also investigated. Both the grain size and the intensity of donor-acceptor pair (DAP) emission in photoluminescence (PL) spectra were decreased by the effect of CdCl{sub 2} addition. Zn content in CZT films was controlled by the ZnTe ratio in the CdTe/ZnTe powder sources. (copyright 2014 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

  16. HERITABILITY AND BREEDING VALUE OF SHEEP FERTILITY ESTIMATED BY MEANS OF THE GIBBS SAMPLING METHOD USING THE LINEAR AND THRESHOLD MODELS

    Directory of Open Access Journals (Sweden)

    DARIUSZ Piwczynski

    2013-03-01

    Full Text Available The research was carried out on 4,030 Polish Merino ewes born in the years 1991- 2001, kept in 15 flocks from the Pomorze and Kujawy region. Fertility of ewes in subsequent reproduction seasons was analysed with the use of multiple logistic regression. The research showed that there is a statistical influence of the flock, year of birth, age of dam, flock year interaction of birth on the ewes fertility. In order to estimate the genetic parameters, the Gibbs sampling method was applied, using the univariate animal models, both linear as well as threshold. Estimates of fertility depending on the model equalled 0.067 to 0.104, whereas the estimates of repeatability equalled respectively: 0.076 and 0.139. The obtained genetic parameters were then used to estimate the breeding values of the animals in terms of controlled trait (Best Linear Unbiased Prediction method using linear and threshold models. The obtained animal breeding values rankings in respect of the same trait with the use of linear and threshold models were strongly correlated with each other (rs = 0.972. Negative genetic trends of fertility (0.01-0.08% per year were found.

  17. New Comment on Gibbs Density Surface of Fluid Argon: Revised Critical Parameters, L. V. Woodcock, Int. J. Thermophys. (2014) 35, 1770-1784

    Science.gov (United States)

    Umirzakov, I. H.

    2018-01-01

    The author comments on an article by Woodcock (Int J Thermophys 35:1770-1784, 2014), who investigates the idea of a critical line instead of a single critical point using the example of argon. In the introduction, Woodcock states that "The Van der Waals critical point does not comply with the Gibbs phase rule. Its existence is based upon a hypothesis rather than a thermodynamic definition". The present comment is a response to the statement by Woodcock. The comment mathematically demonstrates that a critical point is not only based on a hypothesis that is used to define values of two parameters of the Van der Waals equation of state. Instead, the author argues that a critical point is a direct consequence of the thermodynamic phase equilibrium conditions resulting in a single critical point. It is shown that the thermodynamic conditions result in the first and second partial derivatives of pressure with respect to volume at constant temperature at a critical point equal to zero which are usual conditions of an existence of a critical point.

  18. Experimental and computational study of the thermodynamic properties of 2-nitrofluorene and 2-aminofluorene

    International Nuclear Information System (INIS)

    Oliveira, Juliana A.S.A.; Monte, Manuel J.S.; Notario, R.; Ribeiro da Silva, Maria D.M.C.

    2014-01-01

    Highlights: • A thermodynamic study of two fluorene derivatives is presented. • Vapour pressures and energies of combustion were measured. • Enthalpy, entropy and Gibbs energy of sublimation were derived. • Enthalpy and Gibbs energy of formation in crystal and gas phases were calculated. • Gas phase enthalpy of formation was also estimated by quantum chemical calculations. - Abstract: This report presents a comprehensive experimental and computational study of the thermodynamic properties of two fluorene derivatives: 2-aminofluorene and 2-nitrofluorene. The standard (p° = 0.1 MPa) molar enthalpies of formation in the crystalline phase of these compounds were derived from the standard molar energies of combustion, in oxygen, at T = 298.15 K, measured by static bomb combustion calorimetry. A Knudsen effusion method was used to perform the vapour pressure study of the referred compounds, yielding an accurate determination of the standard molar enthalpies and entropies of sublimation. The enthalpies of sublimation were also determined using Calvet microcalorimetry and the enthalpy and temperature of fusion were derived from DSC experiments. Derived results of standard enthalpy and Gibbs energy of formation in both gaseous and crystalline phases were compared with the ones reported in literature for fluorene. A theoretical study at the G3 and G4 levels has been carried out, and the calculated enthalpies of formation have been compared to the experimental values

  19. The thermodynamics of protein folding: a critique of widely used quasi-thermodynamic interpretations and a restatement based on the Gibbs-Duhem relation and consistent with the Phase Rule.

    Science.gov (United States)

    Pethica, Brian A

    2010-07-21

    Interpretations of data in the extensive literature on the unfolding of proteins in aqueous solution follow a variety of methods involving assumptions leading to estimates of thermodynamic quantities associated with the unfolding transition. Inconsistencies and thermodynamic errors in these methods are identified. Estimates of standard molar free energies and enthalpies of unfolding using incompletely defined equilibrium constants and the van't Hoff relation are unsound, and typically contradict model-free interpretation of the data. A widely used routine for estimating the change in heat capacity associated with unfolding based on changes in the unfolding temperature and enthalpy co-induced by addition of denaturant or protective additives is thermodynamically incorrect by neglect of the Phase Rule. Many models and simulations predicting thermodynamic measures of unfolding are presently making comparisons with insecure quantities derived by incorrect thermodynamic analyses of experimental data. Analysis of unfolding via the Gibbs-Duhem equation with the correct Phase Rule constraints avoids the assumptions associated with incomplete equilibrium constants and misuse of the van't Hoff relation, and applies equally to positive, negative, sitewise or diffuse solute binding to the protein. The method gives the necessary relations between the thermodynamic parameters for thermal and isothermal unfolding and is developed for the case of two-state unfolding. The differences in binding of denaturants or stabilizers to the folded and unfolded forms of the protein are identified as major determinants of the unfolding process. The Phase Rule requires the temperature and enthalpy of unfolding to depend generally on the protein concentration. The available evidence bears out this expectation for thermal unfolding, indicating that protein-protein interactions influence folding. A parallel dependence of the denaturant concentrations for isothermal unfolding on the protein

  20. On the contribution of intramolecular zero point energy to the equation of state of solid H2

    Science.gov (United States)

    Chandrasekharan, V.; Etters, R. D.

    1978-01-01

    Experimental evidence shows that the internal zero-point energy of the H2 molecule exhibits a relatively strong pressure dependence in the solid as well as changing considerably upon condensation. It is shown that these effects contribute about 6% to the total sublimation energy and to the pressure in the solid state. Methods to modify the ab initio isolated pair potential to account for these environmental effects are discussed.

  1. Estimativa por DSC das entalpias de sublimação da etilenouréia e da propilenouréia: algumas correlações empíricas envolvendo amidas e tioamidas Estimative by DSC data of the sublimation enthalpies for ethyleneurea and propyleneurea: some empirical correlations with amides and tioamides

    Directory of Open Access Journals (Sweden)

    Robson Fernandes de Farias

    1999-07-01

    Full Text Available By using DSC data, the enthaplies of sublimation for ethyleneurea and propyleneurea, are calculated as 84 and 89 kJ mol-1 respectively. Using the vaporization enthalpy values for dimethylethyleneurea and dimethylprophyleneurea, as obtained from literature, the empirical relation: Dcrg Hmo (1/ Dcrg Hmo (2 = Dlg Hmo (1/ Dlg Hmo(2 = constant, that relate sublimation or vaporization enthalpies of two different substances and of its methylated derivatives, is obtained. Correlations like that are found to another ureas and thioureas.

  2. Energies; Energies

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    2003-07-01

    In the framework of the National Debate on the energies in a context of a sustainable development some associations for the environment organized a debate on the nuclear interest facing the renewable energies. The first part presents the nuclear energy as a possible solution to fight against the greenhouse effect and the associated problem of the wastes management. The second part gives information on the solar energy and the possibilities of heat and electric power production. A presentation of the FEE (French wind power association) on the situation and the development of the wind power in France, is also provided. (A.L.B.)

  3. A sublimação jurídica da função social da propriedade The legal sublimation of the social function of property

    Directory of Open Access Journals (Sweden)

    Rafael Lazzarotto Simioni

    2006-01-01

    Full Text Available O sentido sociológico da função social da propriedade oscila sobre um paradoxo que as teorias jurídicas e políticas do pós-guerra escondem através da idéia do Estado de Direito e do Estado Benfeitor. A função social da propriedade ilustra esse estágio de desenvolvimento das relações comunicativas entre a Política e o Direito, onde a primeira não tem alternativa senão transferir seus conflitos para o segundo, transformando os conflitos políticos em conflitos jurídicos. Como será visto neste artigo, o resultado dessa sublimação jurídica dos conflitos políticos é a generalização simbólica das expectativas políticas na forma de expectativas normativas, que nessas condições podem ser tranqüilizadas artificialmente pela programação condicional do Direito.The social function of property oscillates on a paradox that the juridical and political theories of the postwar period hide through the idea of the Rule of Law and the Welfare State. The social function of property illustrates that development of the communicative relations between Politics and Law, in which the first transfers its conflicts to the latter, turning political conflicts into legal ones. As it will be seen in this article, the result of that legal sublimation of the political conflicts is the symbolic generalization of the political expectations in the form of normative expectations, so that in those conditions they can be artificially tranquilized by the conditional programming of the Law.

  4. Quasi-Phase Diagrams at Air/Oil Interfaces and Bulk Oil Phases for Crystallization of Small-Molecular Semiconductors by Adjusting Gibbs Adsorption.

    Science.gov (United States)

    Watanabe, Satoshi; Ohta, Takahisa; Urata, Ryota; Sato, Tetsuya; Takaishi, Kazuto; Uchiyama, Masanobu; Aoyama, Tetsuya; Kunitake, Masashi

    2017-09-12

    The temperature and concentration dependencies of the crystallization of two small-molecular semiconductors were clarified by constructing quasi-phase diagrams at air/oil interfaces and in bulk oil phases. A quinoidal quaterthiophene derivative with four alkyl chains (QQT(CN)4) in 1,1,2,2-tetrachroloethane (TCE) and a thienoacene derivative with two alkyl chains (C8-BTBT) in o-dichlorobenzene were used. The apparent crystal nucleation temperature (T n ) and dissolution temperature (T d ) of the molecules were determined based on optical microscopy examination in closed glass capillaries and open dishes during slow cooling and heating processes, respectively. T n and T d were considered estimates of the critical temperatures for nuclear formation and crystal growth, respectively. The T n values of QQT(CN)4 and C8-BTBT at the air/oil interfaces were higher than those in the bulk oil phases, whereas the T d values at the air/oil interfaces were almost the same as those in the bulk oil phases. These Gibbs adsorption phenomena were attributed to the solvophobic effect of the alkyl chain moieties. The temperature range between T n and T d corresponds to suitable supercooling conditions for ideal crystal growth based on the suppression of nucleation. The T n values at the water/oil and oil/glass interfaces did not shift compared with those of the bulk phases, indicating that adsorption did not occur at the hydrophilic interfaces. Promotion and inhibition of nuclear formation for crystal growth of the semiconductors were achieved at the air/oil and hydrophilic interfaces, respectively.

  5. New direct estimates of Iceland-Scotland Overflow Water transport through the Charlie-Gibbs Fracture Zone and its relationship to the North Atlantic Current

    Science.gov (United States)

    Bower, Amy; Furey, Heather; Xu, Xiaobiao

    2015-04-01

    Detailed observations of the pathways, transports and water properties of dense overflows associated with the Atlantic Meridional Overturning Circulation (AMOC) provide critical benchmarks for climate models and mixing parameterizations. A recent two-year time series from eight moorings offers the first long-term simultaneous observations of the hydrographic properties and transport of Iceland-Scotland Overflow Water (ISOW) flowing westward through the Charlie-Gibbs Fracture Zone (CGFZ), a major deep gap in the Mid-Atlantic Ridge (MAR) connecting the eastern and western basins of the North Atlantic. In addition, current meters up to 500-m depth and satellite altimetry allow us to investigate the overlying North Atlantic Current (NAC) as a source of ISOW transport variability. Using the isohaline 34.94 to define the ISOW layer, the two year mean and standard deviation of ISOW transport was -1.7 ± 1.5 Sv, compared to -2.4 ± 3.0 Sv reported by Saunders for a 13-month period in 1988-1989 using the same isohaline. Differences in the two estimates are partly explained by limitations of the Saunders array, but more importantly reflect the strong low-frequency variability in ISOW transport through CGFZ (which includes complete reversals). Both the observations and output from a multi-decadal simulation of the North Atlantic using the Hybrid Coordinate Ocean Model (HYCOM) forced with interannually varying wind and buoyancy fields indicate a strong positive correlation between ISOW transport and the strength of the NAC through the CGFZ. This result raises new questions regarding the interaction of the upper and lower limbs of the AMOC, downstream propagation of ISOW transport variability in the Deep Western Boundary Current and alternative pathways of ISOW across the MAR.

  6. Thermodynamic modeling of the stacking fault energy of austenitic steels

    International Nuclear Information System (INIS)

    Curtze, S.; Kuokkala, V.-T.; Oikari, A.; Talonen, J.; Haenninen, H.

    2011-01-01

    The stacking fault energies (SFE) of 10 austenitic steels were determined in the temperature range 50 ≤ T ≤ 600 K by thermodynamic modeling of the Fe-Cr-Ni-Mn-Al-Si-Cu-C-N system using a modified Olson and Cohen modeling approach (Olson GB, Cohen M. Metall Trans 1976;7A:1897 ). The applied model accounts for each element's contribution to the Gibbs energy, the first-order excess free energies, magnetic contributions and the effect of interstitial nitrogen. Experimental SFE values from X-ray diffraction measurements were used for comparison. The effect of SFE on deformation mechanisms was also studied by electron backscatter diffraction.

  7. Gibbs measures and phase transitions

    CERN Document Server

    Georgii, Hans-Otto

    2011-01-01

    From a review of the first edition: ""This book […] covers in depth a broad range of topics in the mathematical theory of phase transition in statistical mechanics. […] It is in fact one of the author's stated aims that this comprehensive monograph should serve both as an introductory text and as a reference for the expert."" (F. Papangelou, Zentralblatt MATH) The second edition has been extended by a new section on large deviations and some comments on the more recent developments in the area.

  8. Generalized TBA and generalized Gibbs

    NARCIS (Netherlands)

    Mossel, J.; Caux, J.-S.

    2012-01-01

    We consider the extension of the thermodynamic Bethe Ansatz to cases in which additional terms involving higher conserved charges are added to the Hamiltonian, or in which a distinction is made between the Hamiltonian used for time evolution and that used for defining the density matrix. Writing

  9. Energies; Energies

    Energy Technology Data Exchange (ETDEWEB)

    Cotard, E.

    2002-02-01

    A review is made about the consequences of the European directive on energy that entered into application in august 2000. It appears that most countries are opening their electricity and gas markets at a faster pace than required by the E.U. directive. European gas imports reached 480 Gm{sup 3} in 2000 and are expected to be over 700 Gm{sup 3} in 2015, so the question of the reliability of the gas suppliers has to be answered at the European level. The current time is marked by an increase of the complexity of the energy market that is due to different factors: 1) the delay in the implementation of European energy directives in France, 2) new arrangement is occurring in United-Kingdom in the energy sector, 3) the lack of a regulating authority in Germany, and 4) the difficulty of inter-connecting the different European energy networks. This transitory period may generate some economic imbalances and competition disturbances by allowing some enterprises to benefit from lower energy prices before others. (A.C.)

  10. Evolution: Prosaically About the Sublime

    Directory of Open Access Journals (Sweden)

    Vladimir Shashkov

    2016-10-01

    Full Text Available Since the origin of mankind, every living person has tried to the best of his abilities to comprehend his presence in the world around. The question, around which, in one way or another, the topic of evolution centers. All this time, apparently not really successful attempts to create a unified world view have not stopped. The complexity of the problem lies in the fact that, while solving, it is necessary to understand a complex of interconnected intricate problems. Among them there are answers to the following questions: which principles define the evolutionary processes; how can appear and on what principles can function such an apparatus as the brain; how can this apparatus self-identify in its own environment, how it interacts with it; how appear and on what principles form its social relations with the ones of its kind? Afterward, there inevitably appears a necessity to thoroughly consider at least two more topics – appearance of metrology and terminology as the tools of self-identification and mutual understanding, their possibilities and limits of application. Solving of these tasks gives a rather definite base for rational correction of all the fundamental created by the mankind in the sphere of theoretical underpinning of all things, gives an opportunity to select reliable schemes to forecast the future of the mankind. In the format of an article it is complicated to consider the whole complex of tasks, one can only briefly mark some of the main provisions and conclusions, formulate as far as possible the basic provision, on the basis of which an attempt to build a rather equivalent reality of the world order is conducted. Below follows a detailed description of the effects of two quite interesting regularities that underlie evolutionary processes. The first regularity is the paradox that any single, accidental, and indefinitely small interaction in a system becomes a precedent and inevitably enhances the likelihood of further interactions resulting in a variety of new emerging components in the system. The second regularity is that the speed of interactions in any limited and isolated zone of the system precipitously increases and multiply outstrips what is happening in the system itself.

  11. 4. Infinity and the Sublime

    Directory of Open Access Journals (Sweden)

    Karin Verelst

    2013-12-01

    Full Text Available In their recent work, L. Graham and J.-M. Kantor discuss a remarkable connection between diverging conceptions of the mathematical infinite in Russia and France at the beginning of the twentieth century and the religious convictions of their respective authors. They expand much more on the Russian side of the cultural equation they propose; I do believe, however, that the French (or rather ‘West European’ side is more complex than it seems, and that digging deeper into it is worthwhile. In this paper I shall therefore broaden the path laid out in Graham and Kantor’s work, by connecting two different strands of research concerning the origin of what I loosely call ‘formal’ ideas: firstly, the rich but complex relation between logic and rhetoric throughout European cultural history, and secondly, the impact of religious convictions on the formation of certain mathematical and scientific ideas during Renaissance and Early Modernity, especially but not exclusively in France.

  12. Teaching elementary thermodynamics and energy conversion: Opinions

    International Nuclear Information System (INIS)

    Gaggioli, Richard A.

    2010-01-01

    This presentation deals with innovation in teaching and understanding of thermodynamic principles. Key features of the approach being advocated are: (a) postulation of the existence of entropy, (b) explicitly associating energy transfers with other transports, (c) stating the 2nd Law in terms of Gibbs' available-energy, (d) systematic use of software such as EES. The paper outlines and elaborates upon an introductory course. Major headings in the course are: basic concepts: properties, additive properties and balances, primitive properties, energy, 1st Law. entropy, elementary academic applications of balances, available-energy, second law, exergy, thermostatic property relations, EES. Applications to processes, fluid flow, Heat transfer, thermochemical. Applications to devices, single-process, compound-process, systems (consisting of devices and processes functioning together).

  13. A Short Essay on the Uses of Free Energy

    OpenAIRE

    Koutandos, Spyridon

    2013-01-01

    In this article we examine cases of more classical and less classical nature compared to results found by quantum mechanics and attribute a form of Free Energy discontinuity for each case within a boundary layer. The concept of a boundary layer is broadened as to include areas of first or second variations of the Gibbs free energy. It is constructive to think not only of implosions like boundary layers but also of explosion like ones. Situations such as boiling and the passage of electric cur...

  14. Application of a linear free energy relationship to crystalline solids of MO2 and M(OH)4

    International Nuclear Information System (INIS)

    Xu Huifang; Barton, L.L.

    1999-01-01

    In this letter, a linear free energy relationship developed by Sverjensky and Molling is used to predict the Gibbs free energies of formation of crystalline phases of M 4+ O 2 and M 4+ (OH) 4 from the known thermodynamic properties of aqueous tetravalent cations (M 4+ ). The modified Sverjensky and Molling equation for tetravalent cations is expressed as ΔG 0 f,M v X = a M v X ΔG 0 n,M 4+ + b M v X + β M v X r M 4+ , where the coefficients a M v X , b M v X and β M v X characterize a particular structural family of M v X, r M 4+ is the ionic radius of M 4+ cation, ΔG 0 f,M v X is the standard Gibbs free energy of formation of M v X, and ΔG 0 n,M 4+ is the standard non-solvation energy of cation M 4+ . By fitting the equation to the existing thermodynamic data, the coefficients in the equation for the MO 2 family minerals are estimated to be: a M v X = 0.670, β M v X = 32 (kcal/mol A), and b = -430.02 (kcal/mol). The constrained relationship can be used to predict the standard Gibbs free energies of formation of crystalline phases and fictive phases (i.e., phases which are thermodynamically unstable and do not occur at standard conditions) within the isostructural families of M 4+ O 2 and M 4+ (OH) 4 if the standard Gibbs free energies of formation of the tetravalent cations are known. (orig.)

  15. Derrida's Generalized Random Energy models; 4, Continuous state branching and coalescents

    CERN Document Server

    Bovier, A

    2003-01-01

    In this paper we conclude our analysis of Derrida's Generalized Random Energy Models (GREM) by identifying the thermodynamic limit with a one-parameter family of probability measures related to a continuous state branching process introduced by Neveu. Using a construction introduced by Bertoin and Le Gall in terms of a coherent family of subordinators related to Neveu's branching process, we show how the Gibbs geometry of the limiting Gibbs measure is given in terms of the genealogy of this process via a deterministic time-change. This construction is fully universal in that all different models (characterized by the covariance of the underlying Gaussian process) differ only through that time change, which in turn is expressed in terms of Parisi's overlap distribution. The proof uses strongly the Ghirlanda-Guerra identities that impose the structure of Neveu's process as the only possible asymptotic random mechanism.

  16. Thermodynamics of metabolic pathways for penicillin production: Analysis of thermodynamic feasibility and free energy changes during fed-batch cultivation

    DEFF Research Database (Denmark)

    Pissarra, P.D.; Nielsen, Jens Bredal

    1997-01-01

    This paper describes the thermodynamic analysis of pathways related to penicillin production in Penicillium chrysogenum. First a thermodynamic feasibility analysis is performed of the L-lysine pathway of which one of the precursors for penicillin biosynthesis (alpha-aminoadipic acid......) is an intermediate. It is found that the L-lysine pathway in P. chrysogenum is thermodynamically feasible and that the calculated standard Gibbs free energy values of the two enzymes controlling the pathway flux indicate that they operate far from equilibrium. It is therefore proposed that the regulation of alpha......-aminoadipate reductase by lysine is important to maintain a high concentration of alpha-aminoadipate in order to direct the carbon flux to penicillin production. Secondly the changes in Gibbs free energy in the penicillin biosynthetic pathway during fed-batch cultivation were studied. The analysis showed that all...

  17. The interfacial free energy of solid Sn on the boundary interface with liquid Cd-Sn eutectic solution

    International Nuclear Information System (INIS)

    Saatci, B; Cimen, S; Pamuk, H; Guenduez, M

    2007-01-01

    Equilibrated grain boundary groove shapes for solid Sn in equilibrium with Cd-Sn liquid were directly observed after annealing a sample at the eutectic temperature for about 8 days. The thermal conductivities of the solid phase, K S , and the liquid phase, K L , for the groove shapes were measured. From the observed groove shapes, the Gibbs-Thomson coefficients were obtained with a numerical method, using the measured G, K S and K L values. The solid-liquid interfacial energy of solid Sn in equilibrium with Cd-Sn liquid was determined from the Gibbs-Thomson equation. The grain boundary energy for solid Sn was also calculated from the observed groove shapes

  18. Low Temperature Growth of In2O3and InN Nanocrystals on Si(111 via Chemical Vapour Deposition Based on the Sublimation of NH4Cl in In

    Directory of Open Access Journals (Sweden)

    Tsokkou Demetra

    2009-01-01

    Full Text Available Abstract Indium oxide (In2O3 nanocrystals (NCs have been obtained via atmospheric pressure, chemical vapour deposition (APCVD on Si(111 via the direct oxidation of In with Ar:10% O2at 1000 °C but also at temperatures as low as 500 °C by the sublimation of ammonium chloride (NH4Cl which is incorporated into the In under a gas flow of nitrogen (N2. Similarly InN NCs have also been obtained using sublimation of NH4Cl in a gas flow of NH3. During oxidation of In under a flow of O2the transfer of In into the gas stream is inhibited by the formation of In2O3around the In powder which breaks up only at high temperatures, i.e.T > 900 °C, thereby releasing In into the gas stream which can then react with O2leading to a high yield formation of isolated 500 nm In2O3octahedrons but also chains of these nanostructures. No such NCs were obtained by direct oxidation forT G < 900 °C. The incorporation of NH4Cl in the In leads to the sublimation of NH4Cl into NH3and HCl at around 338 °C which in turn produces an efficient dispersion and transfer of the whole In into the gas stream of N2where it reacts with HCl forming primarily InCl. The latter adsorbs onto the Si(111 where it reacts with H2O and O2leading to the formation of In2O3nanopyramids on Si(111. The rest of the InCl is carried downstream, where it solidifies at lower temperatures, and rapidly breaks down into metallic In upon exposure to H2O in the air. Upon carrying out the reaction of In with NH4Cl at 600 °C under NH3as opposed to N2, we obtain InN nanoparticles on Si(111 with an average diameter of 300 nm.

  19. Thermodynamic and energy efficiency analysis of power generation from natural salinity gradients by pressure retarded osmosis.

    Science.gov (United States)

    Yip, Ngai Yin; Elimelech, Menachem

    2012-05-01

    The Gibbs free energy of mixing dissipated when fresh river water flows into the sea can be harnessed for sustainable power generation. Pressure retarded osmosis (PRO) is one of the methods proposed to generate power from natural salinity gradients. In this study, we carry out a thermodynamic and energy efficiency analysis of PRO work extraction. First, we present a reversible thermodynamic model for PRO and verify that the theoretical maximum extractable work in a reversible PRO process is identical to the Gibbs free energy of mixing. Work extraction in an irreversible constant-pressure PRO process is then examined. We derive an expression for the maximum extractable work in a constant-pressure PRO process and show that it is less than the ideal work (i.e., Gibbs free energy of mixing) due to inefficiencies intrinsic to the process. These inherent inefficiencies are attributed to (i) frictional losses required to overcome hydraulic resistance and drive water permeation and (ii) unutilized energy due to the discontinuation of water permeation when the osmotic pressure difference becomes equal to the applied hydraulic pressure. The highest extractable work in constant-pressure PRO with a seawater draw solution and river water feed solution is 0.75 kWh/m(3) while the free energy of mixing is 0.81 kWh/m(3)-a thermodynamic extraction efficiency of 91.1%. Our analysis further reveals that the operational objective to achieve high power density in a practical PRO process is inconsistent with the goal of maximum energy extraction. This study demonstrates thermodynamic and energetic approaches for PRO and offers insights on actual energy accessible for utilization in PRO power generation through salinity gradients. © 2012 American Chemical Society

  20. Thermodynamic chemical energy transfer mechanisms of non-equilibrium, quasi-equilibrium, and equilibrium chemical reactions

    International Nuclear Information System (INIS)

    Roh, Heui-Seol

    2015-01-01

    Chemical energy transfer mechanisms at finite temperature are explored by a chemical energy transfer theory which is capable of investigating various chemical mechanisms of non-equilibrium, quasi-equilibrium, and equilibrium. Gibbs energy fluxes are obtained as a function of chemical potential, time, and displacement. Diffusion, convection, internal convection, and internal equilibrium chemical energy fluxes are demonstrated. The theory reveals that there are chemical energy flux gaps and broken discrete symmetries at the activation chemical potential, time, and displacement. The statistical, thermodynamic theory is the unification of diffusion and internal convection chemical reactions which reduces to the non-equilibrium generalization beyond the quasi-equilibrium theories of migration and diffusion processes. The relationship between kinetic theories of chemical and electrochemical reactions is also explored. The theory is applied to explore non-equilibrium chemical reactions as an illustration. Three variable separation constants indicate particle number constants and play key roles in describing the distinct chemical reaction mechanisms. The kinetics of chemical energy transfer accounts for the four control mechanisms of chemical reactions such as activation, concentration, transition, and film chemical reactions. - Highlights: • Chemical energy transfer theory is proposed for non-, quasi-, and equilibrium. • Gibbs energy fluxes are expressed by chemical potential, time, and displacement. • Relationship between chemical and electrochemical reactions is discussed. • Theory is applied to explore nonequilibrium energy transfer in chemical reactions. • Kinetics of non-equilibrium chemical reactions shows the four control mechanisms

  1. Solid-liquid interfacial energy of aminomethylpropanediol

    International Nuclear Information System (INIS)

    Ocak, Yavuz; Keslioglu, Kazim; Marasli, Necmettin; Akbulut, Sezen

    2008-01-01

    The grain boundary groove shapes for equilibrated solid aminomethylpropanediol, 2-amino-2 methyl-1.3 propanediol (AMPD) with its melt were directly observed by using a horizontal temperature gradient stage. From the observed grain boundary groove shapes, the Gibbs-Thomson coefficient (Γ), solid-liquid interfacial energy (σ SL ) and grain boundary energy (σ gb ) of AMPD have been determined to be (5.4 ± 0.5) x 10 -8 K m, (8.5 ± 1.3) x 10 -3 J m -2 and (16.5 ± 2.8) x 10 -3 J m -2 , respectively. The ratio of thermal conductivity of equilibrated liquid phase to solid phase for the AMPD has also been measured to be 1.12 at the melting temperature

  2. Solid-liquid interfacial energy of aminomethylpropanediol

    Energy Technology Data Exchange (ETDEWEB)

    Ocak, Yavuz; Keslioglu, Kazim; Marasli, Necmettin [Department of Physics, Faculty of Arts and Sciences, Erciyes University, 38039 Kayseri (Turkey); Akbulut, Sezen [Department of Physics, Institute of Science and Technology, Erciyes University, 38039 Kayseri (Turkey)], E-mail: marasli@erciyes.edu.tr

    2008-03-21

    The grain boundary groove shapes for equilibrated solid aminomethylpropanediol, 2-amino-2 methyl-1.3 propanediol (AMPD) with its melt were directly observed by using a horizontal temperature gradient stage. From the observed grain boundary groove shapes, the Gibbs-Thomson coefficient ({gamma}), solid-liquid interfacial energy ({sigma}{sub SL}) and grain boundary energy ({sigma}{sub gb}) of AMPD have been determined to be (5.4 {+-} 0.5) x 10{sup -8} K m, (8.5 {+-} 1.3) x 10{sup -3} J m{sup -2} and (16.5 {+-} 2.8) x 10{sup -3} J m{sup -2}, respectively. The ratio of thermal conductivity of equilibrated liquid phase to solid phase for the AMPD has also been measured to be 1.12 at the melting temperature.

  3. Continuous solid-state phase transitions in energy storage materials with orientational disorder – Computational and experimental approach

    International Nuclear Information System (INIS)

    Singh, Harpreet; Talekar, Anjali; Chien, Wen-Ming; Shi, Renhai; Chandra, Dhanesh; Mishra, Amrita; Tirumala, Muralidhar; Nelson, Daryl J.

    2015-01-01

    We report on TES (thermal energy storage) in new CT (continuous phase transitions) in multicomponent tetrahederally configured (orientationally disordered) crystals of NPG-neopentylglycol-C 5 H 12 O 2 , PG-pentaglycerine-C 5 H 12 O 3 , and PE-pentaerythritol-C 5 H 12 O 4 . This discovery is applicable in thermal energy storage in many systems which do not require conventional isothermal first-order phase transition energy storage. The above compounds exhibit polymorphs of orientationally disordered phases in which O–H…O bond rotation around the C–C bond stores significant amount of energy; for example, in PE 41.26 kJ/mol are absorbed isothermally during solid–solid transitions. In this paper we show, anisothermal continuous phase transitions (CT), due to compositional changes with changes in temperature, associated with a measurable amount of energy, not reported earlier. The correlation of phase stability regions in pseudo-binaries, calculated from ternary NPG–PG–PE phase diagrams, is validated by experimental ternary DSC (differential scanning calorimetry) and in-situ x-ray diffraction data. We established equations for determining the CT in a temperature range, and their respective enthalpies of transitions for any composition of the ternaries. Thermodynamic calculations of the Gibbs energies of the solution phases are modeled as substitutional solid solutions, in which the excess Gibbs energies are expressed by the Redlich–Kister–Muggianu polynomial. There is excellent agreement between the experimental and CALPHAD calculated data. - Highlights: • Continuous phase transition (CT) thermal energy storage in organic ternary system. • Anisothermal temperature ramping leads to CT transitions as per lever rule. • Orientationally disordered phases store energy in O–H…O bond rotation/oscillation. • Validated calculated data with measured thermodynamic properties in ternary system. • Used CALPHAD methodology to calculate Gibbs energies of

  4. Standard molar enthalpies of formation of 1- and 2-cyanonaphthalene

    International Nuclear Information System (INIS)

    Ribeiro da Silva, Manuel A.V.; Lobo Ferreira, Ana I.M.C.; Barros, Ana L.M.; Bessa, Ana R.C.; Brito, Barbara C.S.A.; Vieira, Joana A.S.; Martins, Silvia A.P.

    2011-01-01

    Highlights: → Enthalpies of formation of 1- and 2-cyanonaphthalene were measured by combustion calorimetry. → Vapor pressures of crystalline 1- and 2-cyanonaphthalene obtained by Knudsen effusion mass loss technique. → Enthalpies, entropies and Gibbs functions of sublimation at T = 298.15 K were calculated. - Abstract: The standard (p o = 0.1 MPa) molar enthalpies of formation, in the crystalline state, of the 1- and 2-cyanonaphthalene were derived from the standard molar energies of combustion, in oxygen, at T = 298.15 K, measured by static-bomb combustion calorimetry. Vapor pressure measurements at different temperatures, using the Knudsen mass loss effusion technique, enabled the determination of the enthalpy, entropy, and Gibbs energy of sublimation, at T = 298.15 K, for both isomers. The standard molar enthalpies of sublimation, at T = 298.15 K, for 1- and 2-cyanonaphthalene, were also measured by high-temperature Calvet microcalorimetry. (table) Combining these two experimental values, the gas-phase standard molar enthalpies, at T = 298.15 K, were derived and compared with those estimated by employing two different methodologies: one based on the Cox scheme and the other one based on G3MP2B3 calculations. The calculated values show a good agreement with the experimental values obtained in this work.

  5. Transportation Energy - Sandia Energy

    Science.gov (United States)

    Energy Energy Secure & Sustainable Energy Future Search Icon Sandia Home Locations Contact Us Employee Locator Menu Stationary Power solar Energy Conversion Efficiency Increasing the amount of electricity produced from a given thermal energy input. Solar Energy Wind Energy Water Power Supercritical CO2

  6. Energy Research - Sandia Energy

    Science.gov (United States)

    Energy Energy Secure & Sustainable Energy Future Search Icon Sandia Home Locations Contact Us Employee Locator Menu Stationary Power solar Energy Conversion Efficiency Increasing the amount of electricity produced from a given thermal energy input. Solar Energy Wind Energy Water Power Supercritical CO2

  7. Crystallization of glass-forming liquids: Specific surface energy

    International Nuclear Information System (INIS)

    Schmelzer, Jürn W. P.; Abyzov, Alexander S.

    2016-01-01

    A generalization of the Stefan-Skapski-Turnbull relation for the melt-crystal specific interfacial energy is developed in terms of the generalized Gibbs approach extending its standard formulation to thermodynamic non-equilibrium states. With respect to crystal nucleation, this relation is required in order to determine the parameters of the critical crystal clusters being a prerequisite for the computation of the work of critical cluster formation. As one of its consequences, a relation for the dependence of the specific surface energy of critical clusters on temperature and pressure is derived applicable for small and moderate deviations from liquid-crystal macroscopic equilibrium states. Employing the Stefan-Skapski-Turnbull relation, general expressions for the size and the work of formation of critical crystal clusters are formulated. The resulting expressions are much more complex as compared to the respective relations obtained via the classical Gibbs theory. Latter relations are retained as limiting cases of these more general expressions for moderate undercoolings. By this reason, the formulated, here, general relations for the specification of the critical cluster size and the work of critical cluster formation give a key for an appropriate interpretation of a variety of crystallization phenomena occurring at large undercoolings which cannot be understood in terms of the Gibbs’ classical treatment.

  8. A combined experimental and computational thermodynamic study of fluorene-9-methanol and fluorene-9-carboxylic acid

    International Nuclear Information System (INIS)

    Oliveira, Juliana A.S.A.; Calvinho, Maria M.; Notario, R.; Monte, Manuel J.S.; Ribeiro da Silva, Maria D.M.C.

    2013-01-01

    Highlights: • A thermodynamic study of two fluorene derivatives is presented. • Vapour pressures and energies of combustion were measured. • Enthalpy, entropy and Gibbs energy of sublimation were derived. • Enthalpy and Gibbs energy of formation in crystal and gas phases were calculated. • Gas phase enthalpy of formation was also estimated by quantum chemical calculations. -- Abstract: This work reports an experimental and computational thermodynamic study performed on two 9-fluorene derivatives: fluorene-9-methanol and fluorene-9-carboxylic acid. The standard (p o = 0.1 MPa) molar enthalpies of formation in the crystalline phase of these compounds were derived from the standard molar energies of combustion, in oxygen, at T = 298.15 K, measured by static bomb combustion calorimetry. A static method, based on a capacitance diaphragm gauge, and a Knudsen effusion method were used to perform the vapour pressure study of the referred compounds, yielding accurate determination of the standard molar enthalpies and entropies of sublimation and vaporisation. For fluorene-9-carboxylic acid, the enthalpy of sublimation was also determined using Calvet microcalorimetry. The enthalpy of fusion of both compounds was derived indirectly from vapour pressure results and directly from DSC experiments. Combining the thermodynamic parameters of the compounds studied, the standard Gibbs energy of formation in crystalline and gaseous phases were derived as well as the standard molar enthalpy of formation in the gaseous phase. A theoretical study at the G3 and G4 levels has been carried out, and the calculated enthalpies of formation have been compared with the experimental values

  9. Heat transfer coefficients obtainment by means of naphthalene sublimation in air; Obtencion de coeficientes de transferencia de calor por medio de la tecnica de sublimacion de naftalina en aire

    Energy Technology Data Exchange (ETDEWEB)

    Perez Galindo, Jose Arturo; Garcia Gutierrez, Alonso [Instituto de Investigaciones Electricas, Cuernavaca (Mexico)

    1986-12-31

    This work describes the experimental technique for the sublimation of naphthalene in air which measures heat transfer coefficients through the use of the analogy between the transference phenomena of heat and mass. The technique used to substitute the experimental measurements of heat transfer, in which it is difficult to control the border thermal conditions, when they are dimmed by the omnipresent problem of heat conduction through the walls of the transference surfaces. Two examples are included of the application technique and its potential is outlined. [Espanol] En este trabajo se describe la tecnica experimental de la sublimacion de naftalina en aire mediante la que se miden coeficientes de transferencia de masa. Los datos asi obtenidos pueden convertirse en coeficientes de transferencia de calor a traves del uso de la analogia entre los fenomenos de transferencia de calor y masa. La tecnica se utiliza para substituir las mediciones experimentales de transferencia de calor, en las que es dificil controlar las condiciones termicas de frontera, cuando las empana el problema omnipresente de la conduccion de calor a traves de las paredes de las superficies de transferencia. Se incluyen dos ejemplos de la aplicacion de la tecnica y se destaca su potencial.

  10. Heat transfer coefficients obtainment by means of naphthalene sublimation in air; Obtencion de coeficientes de transferencia de calor por medio de la tecnica de sublimacion de naftalina en aire

    Energy Technology Data Exchange (ETDEWEB)

    Perez Galindo, Jose Arturo; Garcia Gutierrez, Alonso [Instituto de Investigaciones Electricas, Cuernavaca (Mexico)

    1985-12-31

    This work describes the experimental technique for the sublimation of naphthalene in air which measures heat transfer coefficients through the use of the analogy between the transference phenomena of heat and mass. The technique used to substitute the experimental measurements of heat transfer, in which it is difficult to control the border thermal conditions, when they are dimmed by the omnipresent problem of heat conduction through the walls of the transference surfaces. Two examples are included of the application technique and its potential is outlined. [Espanol] En este trabajo se describe la tecnica experimental de la sublimacion de naftalina en aire mediante la que se miden coeficientes de transferencia de masa. Los datos asi obtenidos pueden convertirse en coeficientes de transferencia de calor a traves del uso de la analogia entre los fenomenos de transferencia de calor y masa. La tecnica se utiliza para substituir las mediciones experimentales de transferencia de calor, en las que es dificil controlar las condiciones termicas de frontera, cuando las empana el problema omnipresente de la conduccion de calor a traves de las paredes de las superficies de transferencia. Se incluyen dos ejemplos de la aplicacion de la tecnica y se destaca su potencial.

  11. Qualification of a sublimation tool applied to the case of metalorganic chemical vapor deposition of In{sub 2}O{sub 3} from In(tmhd){sub 3} as a solid precursor

    Energy Technology Data Exchange (ETDEWEB)

    Szkutnik, P. D., E-mail: pierre.szkutnik@cea.fr; Jiménez, C. [Université Grenoble Alpes, CNRS, LMGP, 3 Parvis Louis Néel, Minatec CS 50257, 38016 Grenoble Cedex 1 (France); Angélidès, L.; Todorova, V. [Air Liquide Electronics Systems, 8 rue des Méridiens–Sud Galaxie BP 228, 38433 Échirolles Cedex (France)

    2016-02-15

    A solid delivery system consisting of a source canister, a gas management, and temperature controlled enclosure designed and manufactured by Air Liquide Electronics Systems was tested in the context of gas-phase delivery of the In(tmhd){sub 3} solid precursor. The precursor stream was delivered to a thermal metalorganic chemical vapor deposition reactor to quantify deposition yield under various conditions of carrier gas flow and sublimation temperature. The data collected allowed the determination of characteristic parameters such as the maximum precursor flow rate (18.2 mg min{sup −1} in specified conditions) and the critical mass (defined as the minimum amount of precursor able to attain the maximum flow rate) found to be about 2.4 g, as well as an understanding of the influence of powder distribution inside the canister. Furthermore, this qualification enabled the determination of optimal delivery conditions which allowed for stable and reproducible precursor flow rates over long deposition times (equivalent to more than 47 h of experiment). The resulting In{sub 2}O{sub 3} layers was compared with those elaborated via pulsed liquid injection obtained in the same chemical vapor deposition chamber and under the same deposition conditions.

  12. Application of the non-extensive statistical approach to high energy particle collisions

    Science.gov (United States)

    Bíró, Gábor; Barnaföldi, Gergely Gábor; Biró, Tamás Sándor; Ürmössy, Károly

    2017-06-01

    In high-energy collisions the number of created particles is far less than the thermodynamic limit, especially in small colliding systems (e.g. proton-proton). Therefore final-state effects and fluctuations in the one-particle energy distribution are appreciable. As a consequence the characterization of identified hadron spectra with the Boltzmann - Gibbs thermodynamical approach is insuffcient [1]. Instead particle spectra measured in high-energy collisions can be described very well with Tsallis -Pareto distributions, derived from non-extensive thermodynamics [2, 3]. Using the Tsallis q-entropy formula, a generalization of the Boltzmann - Gibbs entropy, we interpret the microscopic physics by analysing the Tsallis q and T parameters. In this paper we give a quick overview on these parameters, analyzing identified hadron spectra from recent years in a wide center-of-mass energy range. We demonstrate that the fitted Tsallis-parameters show dependency on the center-of-mass energy and particle species. Our findings are described well by a QCD inspired evolution ansatz. Based on this comprehensive study, apart from the evolution, both mesonic and barionic components found to be non-extensive (q > 1), beside the mass ordered hierarchy observed in parameter T.

  13. Tissue and size-related changes in the fatty acid and stable isotope signatures of the deep sea grenadier fish Coryphaenoides armatus from the Charlie-Gibbs Fracture Zone region of the Mid-Atlantic Ridge

    Science.gov (United States)

    Mayor, Daniel J.; Sharples, Caroline J.; Webster, Lynda; Walsham, Pamela; Lacaze, Jean-Pierre; Cousins, Nicola J.

    2013-12-01

    Coryphaenoides armatus is a cosmopolitan deep-sea fish that plays a major role in the ecology of abyssal ecosystems. We investigated the trophic ecology and physiology of this species by determining the δ13C, δ15N and fatty acid signatures of muscle, liver and ovary tissues of individuals collected from ∼2700 m to the north and south of the Charlie-Gibbs Fracture Zone (CGFZ) of the Mid-Atlantic Ridge, NE Atlantic. Fatty acid and δ13C data both suggested that C. armatus shows an ontogenetic dietary shift, with the relative contributions of benthic and pelagic prey decreasing and increasing respectively as the animals grow. They also indicated that dietary overlap between animals living to the north and south of the CGFZ increases as they grow, suggesting that larger animals forage over greater distances and are not hindered by the presence of the CGFZ. Comparison of tissue-specific fatty acid signatures with previously published data suggests compositional homeostasis of the fatty acids 20:5(n-3) and 22:6(n-3) in the muscle, and 18:1(n-9) in the liver tissues. We ascribe this primarily to strict physiological requirements for these compounds, rather than simply to their abundance in the diet. We pose several speculative mechanisms to explain the observed trends in tissue-specific δ13C and δ15N values, illustrating some of the numerous processes that can influence the isotopic signatures of bulk tissues.

  14. Energy Analysis in Combined Reforming of Propane

    Directory of Open Access Journals (Sweden)

    K. Moon

    2013-01-01

    Full Text Available Combined (steam and CO2 reforming is one of the methods to produce syngas for different applications. An energy requirement analysis of steam reforming to dry reforming with intermediate steps of steam reduction and equivalent CO2 addition to the feed fuel for syngas generation has been done to identify condition for optimum process operation. Thermodynamic equilibrium data for combined reforming was generated for temperature range of 400–1000°C at 1 bar pressure and combined oxidant (CO2 + H2O stream to propane (fuel ratio of 3, 6, and 9 by employing the Gibbs free energy minimization algorithm of HSC Chemistry software 5.1. Total energy requirement including preheating and reaction enthalpy calculations were done using the equilibrium product composition. Carbon and methane formation was significantly reduced in combined reforming than pure dry reforming, while the energy requirements were lower than pure steam reforming. Temperatures of minimum energy requirement were found in the data analysis of combined reforming which were optimum for the process.

  15. Using reweighting and free energy surface interpolation to predict solid-solid phase diagrams

    Science.gov (United States)

    Schieber, Natalie P.; Dybeck, Eric C.; Shirts, Michael R.

    2018-04-01

    Many physical properties of small organic molecules are dependent on the current crystal packing, or polymorph, of the material, including bioavailability of pharmaceuticals, optical properties of dyes, and charge transport properties of semiconductors. Predicting the most stable crystalline form at a given temperature and pressure requires determining the crystalline form with the lowest relative Gibbs free energy. Effective computational prediction of the most stable polymorph could save significant time and effort in the design of novel molecular crystalline solids or predict their behavior under new conditions. In this study, we introduce a new approach using multistate reweighting to address the problem of determining solid-solid phase diagrams and apply this approach to the phase diagram of solid benzene. For this approach, we perform sampling at a selection of temperature and pressure states in the region of interest. We use multistate reweighting methods to determine the reduced free energy differences between T and P states within a given polymorph and validate this phase diagram using several measures. The relative stability of the polymorphs at the sampled states can be successively interpolated from these points to create the phase diagram by combining these reduced free energy differences with a reference Gibbs free energy difference between polymorphs. The method also allows for straightforward estimation of uncertainties in the phase boundary. We also find that when properly implemented, multistate reweighting for phase diagram determination scales better with the size of the system than previously estimated.

  16. A sublimation technique for high-precision measurements of δ13CO2 and mixing ratios of CO2 and N2O from air trapped in ice cores

    Directory of Open Access Journals (Sweden)

    H. Fischer

    2011-07-01

    Full Text Available In order to provide high precision stable carbon isotope ratios (δ13CO2 or δ13C of CO2 from small bubbly, partially and fully clathrated ice core samples we developed a new method based on sublimation coupled to gas chromatography-isotope ratio mass spectrometry (GC-IRMS. In a first step the trapped air is quantitatively released from ~30 g of ice and CO2 together with N2O are separated from the bulk air components and stored in a miniature glass tube. In an off-line step, the extracted sample is introduced into a helium carrier flow using a minimised tube cracker device. Prior to measurement, N2O and organic sample contaminants are gas chromatographically separated from CO2. Pulses of a CO2/N2O mixture are admitted to the tube cracker and follow the path of the sample through the system. This allows an identical treatment and comparison of sample and standard peaks. The ability of the method to reproduce δ13C from bubble and clathrate ice is verified on different ice cores. We achieve reproducibilities for bubble ice between 0.05 ‰ and 0.07 ‰ and for clathrate ice between 0.05 ‰ and 0.09 ‰ (dependent on the ice core used. A comparison of our data with measurements on bubble ice from the same ice core but using a mechanical extraction device shows no significant systematic offset. In addition to δ13C, the CO2 and N2O mixing ratios can be volumetrically derived with a precision of 2 ppmv and 8 ppbv, respectively.

  17. The Sublime of Beauty——Aesthetic Thinking in the Age of Spiritual Poverty%优美化的崇高——精神贫乏时代的审美思考

    Institute of Scientific and Technical Information of China (English)

    顾颉

    2015-01-01

    The join of aesthetics and ethics in theory is a kind of thinking,a kind of body recognition and a cultural consciousness,which is the collision of the two languages in the face of human existence dilemma. The sublime of beauty is the aesthetic interpretation of the meaning of existence. This strategy,no matter in the social level or from the individual level,is introspection on spiritual weary and the redemption to gradually withered human values,re-thinking and effective reply to the relation between reality and non reality,utilitarianism and non utilitarianism,the instrumental rationality and value rationality.%美学与伦理学在理论上的联姻是从上个世纪90 年代以来非理性文化魔力般地牵动着诸多学者的神经的情况下形成的一种思考、一种体认和一种文化自觉,是两种话语在面对人类生存困境中历史性的碰撞.优美化的崇高正是在此背景下对存在意义的审美解读,这种策略无论在社会层面上还是个体层面,皆是精神贫乏时代审美对精神困顿的反思与人类价值日渐枯萎的救赎,以及对现实与非现实、手段与目的、功利与非功利、工具理性与价值理性关系的重新思考与有效回答.

  18. Models for calculation of dissociation energies of homonuclear diatomic molecules

    International Nuclear Information System (INIS)

    Brewer, L.; Winn, J.S.

    1979-08-01

    The variation of known dissociation energies of the transition metal diatomics across the Periodic Table is rather irregular like the bulk sublimation enthalpy, suggesting that the valence-bond model for bulk metallic systems might be applicable to the gaseous diatomic molecules and the various intermediate clusters. Available dissociation energies were converted to valence-state bonding energies considering various degrees of promotion to optimize the bonding. The degree of promotion of electrons to increase the number of bonding electrons is smaller than for the bulk, but the trends in bonding energy parallel the behavior found for the bulk metals. Thus using the established trends in bonding energies for the bulk elements, it was possible to calculate all unknown dissociation energies to provide a complete table of dissociation energies for all M 2 molecules from H 2 to Lr 2 . For solids such as Mg, Al, Si and most of the transition metals, large promotion energies are offset by strong bonding between the valence state atoms. The main question is whether bonding in the diatomics is adequate to sustain extensive promotion. The most extreme example for which a considerable difference would be expected between the bulk and the diatomics would be that of the Group IIA and IIB metals. The first section of this paper which deals with the alkaline earths Mg and Ca demonstrates a significant influence of the excited valence state even for these elements. The next section then expands the treatment to transition metals

  19. The ecosystem of the Mid-Atlantic Ridge at the sub-polar front and Charlie-Gibbs Fracture Zone; ECO-MAR project strategy and description of the sampling programme 2007-2010

    Science.gov (United States)

    Priede, Imants G.; Billett, David S. M.; Brierley, Andrew S.; Hoelzel, A. Rus; Inall, Mark; Miller, Peter I.; Cousins, Nicola J.; Shields, Mark A.; Fujii, Toyonobu

    2013-12-01

    The ECOMAR project investigated photosynthetically-supported life on the North Mid-Atlantic Ridge (MAR) between the Azores and Iceland focussing on the Charlie-Gibbs Fracture Zone area in the vicinity of the sub-polar front where the North Atlantic Current crosses the MAR. Repeat visits were made to four stations at 2500 m depth on the flanks of the MAR in the years 2007-2010; a pair of northern stations at 54°N in cold water north of the sub-polar front and southern stations at 49°N in warmer water influenced by eddies from the North Atlantic Current. At each station an instrumented mooring was deployed with current meters and sediment traps (100 and 1000 m above the sea floor) to sample downward flux of particulate matter. The patterns of water flow, fronts, primary production and export flux in the region were studied by a combination of remote sensing and in situ measurements. Sonar, tow nets and profilers sampled pelagic fauna over the MAR. Swath bathymetry surveys across the ridge revealed sediment-covered flat terraces parallel to the axis of the MAR with intervening steep rocky slopes. Otter trawls, megacores, baited traps and a suite of tools carried by the R.O.V. Isis including push cores, grabs and a suction device collected benthic fauna. Video and photo surveys were also conducted using the SHRIMP towed vehicle and the R.O.V. Isis. Additional surveying and sampling by landers and R.O.V. focussed on the summit of a seamount (48°44‧N, 28°10‧W) on the western crest of the MAR between the two southern stations.

  20. The Gibbs Function, Spontaneity, and Walls

    Science.gov (United States)

    Tykodi, R. J.

    1996-05-01

    For the expansion-into-the-vacuum process involving a saturated vapor, previously analyzed by Schomaker and waser and by myself, I assert that in general Delta G (composite) is undefined and that for the special case of bulbs with perfectly rigid walls Delta G (composite) is weakly positive. I show that the seemingly contradictory results of Schomaker and Waser are merely the consequences of their use of eccentric or anti-conventional terminology: they calculate the change in the Availability function for the process and call that change "Delta G (composite)".

  1. The Gibbs entropy production in general relativity

    International Nuclear Information System (INIS)

    Henneaux, M.

    1983-01-01

    The entropy production is analyzed in the case of homogeneous cosmological models of the Bianchi type. It is shown to vanish for class-A models and to be undefined for class-B ones, because of an ambiguity in the measure on the space of the true gravitational degrees of freedom. How this results extend to the full Einstein theory is discussed

  2. Gibbs entropy production in general relativity

    International Nuclear Information System (INIS)

    Henneaux, M.

    1983-01-01

    The entropy production is analyzed in the case of homogeneous cosmological models of the Bianchi type. It is shown to vanish for class-A models and to be undefined for class-B ones, because of an ambiguity in the measure on the space of the true gravitational degrees of freedom. How this results extends to the full Einstein theory is discussed

  3. Josiah Willard Gibbs and his Ensembles

    Indian Academy of Sciences (India)

    statistical physics, Monte. Carlo methods, molecular dynamics, radiation .... w ith elastic theories and show ed unam biguously that the em piricalphenom ena in .... the probability of H eads b e p and of T ails b e q = 1 ¡ p. T he sam ple space ...

  4. Magnetomechanical characterization and unified energy model for the quasistatic behavior of ferromagnetic shape memory Ni–Mn–Ga

    International Nuclear Information System (INIS)

    Sarawate, Neelesh N; Dapino, Marcelo J

    2010-01-01

    This paper presents an overview of the characterization and modeling of single crystal ferromagnetic shape memory Ni–Mn–Ga. A continuum thermodynamics model is presented which describes the magnetomechanical characterization of single crystal Ni–Mn–Ga for the following behavior: (i) sensing effect; (ii) actuation effect; (iii) blocked force (stress generation). The thermodynamic potentials, namely the magnetic Gibbs energy and the Gibbs energy, are obtained from the Helmholtz energy in order to arrive at the set of required independent and dependent variables; the potentials include magnetic energy consisting of Zeeman, magnetostatic and anisotropy components, and mechanical energy consisting of elastic and twinning components. Mechanical dissipation and the microstructure of Ni–Mn–Ga are incorporated in the continuum model through the internal state variables volume fraction, domain fraction, and magnetization rotation angle. The constitutive response of the material is obtained by restricting the process through the second law of thermodynamics. The model requires only seven parameters identified from two simple experiments. Several interesting characteristics of Ni–Mn–Ga are examined in concert with the magnetomechanical characterization

  5. The Sublimated Ideology of The Object

    Directory of Open Access Journals (Sweden)

    G.V. Loewen

    2013-12-01

    Full Text Available The idea that ideologies present to us a rationality for making decisions, for getting things done, allows us to avoid the agony of choosing one world or another as a finite being, allows us to forget that it is we ourselves who must do and thus who are also to be done. Due to the work of having to live a human life with others who do not agree with us and will never be our servants, we are all ready to give up responsibilities to the political saviour; already this one presents to ourselves the One and only. By examining our private and picayune dogmatisms, we might gain some insight into why we are ever so often willing to become public fascists. We might well object to being objected to. Along with this, we are also objects in a world of objects. This is routine when compared to the dialectical intersubjectivity of voicing an objection in a throng of objections, of questioning the objectionable in a questionable politics. It is the very mundanity of acquiescence that dulls us to the danger pedestal-dwelling ideologies still represent.

  6. NO reduction using sublimation of cyanuric acid

    Science.gov (United States)

    Perry, R.A.

    1996-05-21

    A method of reducing the NO content of a gas stream comprises contacting the gas stream with an amount of HNCO at a temperature effective for heat-induced decomposition of cyanuric acid, said amount and temperature being effective for the resultant lowering of the NO content of the gas stream, said cyanuric acid being particulate and having a particle size of less than 90 {micro}m. 1 fig.

  7. Energy and energy policy

    International Nuclear Information System (INIS)

    Clerici, A.

    2007-01-01

    Energy has taken with his reflections on the environment, the geopolitical aspects and its pervasive use in all activities a crucial role for sustainable development of our planet. The energy in the future will be increasingly a global problem [it

  8. Constitutive equations for energy balance evaluation in metals under inelastic deformation

    Science.gov (United States)

    Kostina, A.; Plekhov, O.; Venkatraman, B.

    2017-12-01

    The work is devoted to the development of constitutive equations for energy balance evaluation in plastically deformed metals. The evolution of the defect system is described by a previously obtained model based on the Boltzmann-Gibbs statistics. In the framework of this model, a collective behavior of mesodefect ensembles is taken into account by the introduction of an internal variable representing additional structural strain. This parameter enables the partition of plastic work into dissipated heat and stored energy. The proposed model is applied to energy balance calculation in a Ti-1Al-1Mn specimen subjected to cyclic loading. Simulation results have shown that the model is able to describe an upward trend in the stored energy value with the increase in the load ratio.

  9. Prediction of Tetraoxygen Reaction Mechanism with Sulfur Atom on the Singlet Potential Energy Surface

    Directory of Open Access Journals (Sweden)

    Ashraf Khademzadeh

    2014-01-01

    Full Text Available The mechanism of S+O4 (D2h reaction has been investigated at the B3LYP/6-311+G(3df and CCSD levels on the singlet potential energy surface. One stable complex has been found for the S+O4 (D2h reaction, IN1, on the singlet potential energy surface. For the title reaction, we obtained four kinds of products at the B3LYP level, which have enough thermodynamic stability. The results reveal that the product P3 is spontaneous and exothermic with −188.042 and −179.147 kcal/mol in Gibbs free energy and enthalpy of reaction, respectively. Because P1 adduct is produced after passing two low energy level transition states, kinetically, it is the most favorable adduct in the 1S+1O4 (D2h atmospheric reactions.

  10. Discrete lattice plane broken bond interfacial energy calculations and the use of the dividing surface concept

    International Nuclear Information System (INIS)

    Ramanujan, R.V.

    2003-01-01

    The concept of the dividing surface has been extensively used to define the relationships between thermodynamic quantities at the interface between two phases; it is also useful in calculations of interfacial energy (γ). However, in the original formulation, the two phases are continuum phases, the atomistic nature of the interface was not considered. It is, therefore, useful to examine the use of the dividing surface in the context of atomistic interfacial energy calculations. The case of a planar fcc:hcp interface is considered and the dividing surface positions which are useful in atomistic interfacial energy calculations are stated, one position equates γ to the excess internal energy, the other position allows us to use the Gibbs adsorption equation. An example of a calculation using the convenient dividing surface positions is presented

  11. Relationship between dynamical entropy and energy dissipation far from thermodynamic equilibrium

    Science.gov (United States)

    Green, Jason R.; Costa, Anthony B.; Grzybowski, Bartosz A.; Szleifer, Igal

    2013-01-01

    Connections between microscopic dynamical observables and macroscopic nonequilibrium (NE) properties have been pursued in statistical physics since Boltzmann, Gibbs, and Maxwell. The simulations we describe here establish a relationship between the Kolmogorov–Sinai entropy and the energy dissipated as heat from a NE system to its environment. First, we show that the Kolmogorov–Sinai or dynamical entropy can be separated into system and bath components and that the entropy of the system characterizes the dynamics of energy dissipation. Second, we find that the average change in the system dynamical entropy is linearly related to the average change in the energy dissipated to the bath. The constant energy and time scales of the bath fix the dynamical relationship between these two quantities. These results provide a link between microscopic dynamical variables and the macroscopic energetics of NE processes. PMID:24065832

  12. Probability distributions in conservative energy exchange models of multiple interacting agents

    International Nuclear Information System (INIS)

    Scafetta, Nicola; West, Bruce J

    2007-01-01

    Herein we study energy exchange models of multiple interacting agents that conserve energy in each interaction. The models differ regarding the rules that regulate the energy exchange and boundary effects. We find a variety of stochastic behaviours that manifest energy equilibrium probability distributions of different types and interaction rules that yield not only the exponential distributions such as the familiar Maxwell-Boltzmann-Gibbs distribution of an elastically colliding ideal particle gas, but also uniform distributions, truncated exponential distributions, Gaussian distributions, Gamma distributions, inverse power law distributions, mixed exponential and inverse power law distributions, and evolving distributions. This wide variety of distributions should be of value in determining the underlying mechanisms generating the statistical properties of complex phenomena including those to be found in complex chemical reactions

  13. Grain-boundary free energy in an assembly of elastic disks.

    Science.gov (United States)

    Lusk, Mark T; Beale, Paul D

    2004-02-01

    Grain-boundary free energy is estimated as a function of misoriention for symmetric tilt boundaries in an assembly of nearly hard disks. Fluctuating cell theory is used to accomplish this since the most common techniques for calculating interfacial free energy cannot be applied to such assemblies. The results are analogous to those obtained using a Leonard-Jones potential, but in this case the interfacial energy is dominated by an entropic contribution. Disk assemblies colorized with free and specific volume elucidate differences between these two characteristics of boundary structure. Profiles are also provided of the Helmholtz and Gibbs free energies as a function of distance from the grain boundaries. Low angle grain boundaries are shown to follow the classical relationship between dislocation orientation/spacing and misorientation angle.

  14. Alterações físico-químicas e movimentação de íons em Latossolo gibbsítico sob doses de gesso

    Directory of Open Access Journals (Sweden)

    Milson Evaldo Serafim

    2012-01-01

    Full Text Available Com o objetivo de avaliar o efeito de doses de gesso no ponto de carga zero estimado (PCZ, na dinâmica do cálcio, magnésio, potássio e sulfato, e na retenção de água de um Latossolo Vermelho distroférrico gibbsítico, textura muito argilosa, realizou-se experimento em vasos, em casa de vegetação. Foram estudadas seis doses de gesso agrícola (correspondentes a 0, 3, 6, 9, 12 e 15 Mg ha-1 e duas condições de fornecimento de água, "sem veranico" e "com veranico" para a soja cultivada. Na coleta de solo para o experimento foram consideradas as camadas 0-0,2 m e 0,7-0,9 m representando os horizontes A e Bw respectivamente. Foram montados vasos com a sobreposição de dois tubos de PVC de 0,2 m de comprimento e 0,1 m de diâmetro interno, formando duas camadas: a superior, com material do horizonte A, corrigido com calcário dolomítico, e a inferior, com material do horizonte Bw, sem correção do pH; ambas na densidade de 1 kg dm-3. O PCZ foi alterado em função das doses de gesso. Houve aumento dos teores de Ca, também em resposta as doses de gesso. Não houve diferença nos teores de S na camada superficial, mas houve aumento na camada subsuperficial em resposta à dose de gesso. Constatou-se redução nos teores de Mg na camada superficial e elevação na camada subsuperficial, com o aumento das doses de gesso. Não houve variação nos teores de K e na retenção de água para as diferentes doses de gesso e regime de fornecimento de água.

  15. Mass hierarchy and energy scaling of the Tsallis - Pareto parameters in hadron productions at RHIC and LHC energies

    Science.gov (United States)

    Bíró, Gábor; Barnaföldi, Gergely Gábor; Biró, Tamás Sándor; Shen, Keming

    2018-02-01

    The latest, high-accuracy identified hadron spectra measurements in highenergy nuclear collisions led us to the investigation of the strongly interacting particles and collective effects in small systems. Since microscopical processes result in a statistical Tsallis - Pareto distribution, the fit parameters q and T are well suited for identifying system size scalings and initial conditions. Moreover, parameter values provide information on the deviation from the extensive, Boltzmann - Gibbs statistics in finite-volumes. We apply here the fit procedure developed in our earlier study for proton-proton collisions [1, 2]. The observed mass and center-of-mass energy trends in the hadron production are compared to RHIC dAu and LHC pPb data in different centrality/multiplicity classes. Here we present new results on mass hierarchy in pp and pA from light to heavy hadrons.

  16. Energy: nuclear energy

    International Nuclear Information System (INIS)

    Lung, M.

    2000-11-01

    Convinced that the nuclear energy will be the cleaner, safer, more economical and more respectful of the environment energy of the future, the author preconizes to study the way it can be implemented, to continue to improve its production, to understand its virtues and to better inform the public. He develops this opinion in the presentation of the principal characteristics of the nuclear energy: technology, radioactive wastes, radiation protection, the plutonium, the nuclear accidents, the proliferation risks, the economics and nuclear energy and competitiveness, development and sustainability. (A.L.B.)

  17. Cometary Defense with Directed Energy

    Science.gov (United States)

    Zhang, Q.; Lubin, P. M.; Hughes, G. B.

    2016-12-01

    Cometary impacts pose a long-term hazard to humans on Earth. Due to their comparative rarity, most planetary defense schemes neglect the comet threat, choosing instead to focus exclusively on mitigating asteroid impacts. Methods like kinetic impactors may be suitable for deflecting near-Earth asteroids (NEAs) and Jupiter-family comets (JFCs), both of which are characterized by low inclination orbits and short orbital periods which favor early detection—characteristics ideal for an interception mission. In contrast, Halley-type comets (HTCs) and long-period comets (LPCs) are often found in high inclination orbits rarely more than 2 yr prior to reaching Earth's orbit. Unless discovered and identified in a prior apparition—often centuries or millennia earlier, if ever—timely interception of a threatening HTC or LPC is improbable even with preparation, with missions demanding delta-v budgets often in excess of 30 km/s. Active comets, however, are already naturally perturbed from purely gravitational trajectories through solar-driven sublimation of volatiles. Further deflection may be achieved by supplementing the solar radiation with an artificial directed energy source such as by one or more laser arrays positioned on or near Earth. Simulations were developed with models derived from the known solar nongravitational perturbations of typical comets. Results suggest that a diffraction-limited 500 m array operating at 10 GW for 10 min/day may be sufficient to divert a typical active 500 m comet from an impact given 1 yr. A larger 1 km array operating at 100 GW for 100 s/day is similarly effective. Care must be taken to ensure the target remains intact throughout the deflection period due to comets' low compressive strength and resulting propensity for disintegration at high incident flux.

  18. Free energies of stable and metastable pores in lipid membranes under tension.

    Science.gov (United States)

    den Otter, Wouter K

    2009-11-28

    The free energy profile of pore formation in a lipid membrane, covering the entire range from a density fluctuation in an intact bilayer to a large tension-stabilized pore, has been calculated by molecular dynamics simulations with a coarse-grained lipid model. Several fixed elongations are used to obtain the Helmholtz free energy as a function of pore size for thermodynamically stable, metastable, and unstable pores, and the system-size dependence of these elongations is discussed. A link to the Gibbs free energy at constant tension, commonly known as the Litster model, is established by a Legendre transformation. The change of genus upon pore formation is exploited to estimate the saddle-splay modulus or Gaussian curvature modulus of the membrane leaflets. Details are provided of the simulation approach, which combines the potential of mean constraint force method with a reaction coordinate based on the local lipid density.

  19. Theoretical study of γ-aminobutyric acid conformers: Intramolecular interactions and ionization energies

    Science.gov (United States)

    Wang, Ke-Dong; Wang, Mei-Ting; Meng, Ju

    2014-10-01

    Allowing for all combinations of internal single-bond rotamers, 1,296 unique trial structures of γ-Aminobutyric acid (GABA) are obtained. All of these structures are optimized at the M06-2X level of theory and a total of 68 local minimal conformers are found. The nine low-lying conformers are used for further studies. According to the calculated relative Gibbs free energies at M06-2X level of theory, we find that the dispersion is important for the relative energy of GABA. The intramolecular hydrogen bonds and hyperconjugative interaction and their effects on the conformational stability are studied. The results show that both of them have great influence on the conformers. The vertical ionization energies (VIE) are calculated and match the experimental data well. The results show that the neutral GABA in the gas phase is a multi-conformer system and at least four conformations exist.

  20. Growth and intercalation of graphene on silicon carbide studied by low-energy electron microscopy

    Energy Technology Data Exchange (ETDEWEB)

    Speck, Florian; Ostler, Markus; Wanke, Martina; Seyller, Thomas [Universitaet Erlangen-Nuernberg, Lehrstuhl fuer Technische Physik, Erlangen (Germany); Technische Universitaet Chemnitz, Institut fuer Physik (Germany); Besendoerfer, Sven [Universitaet Erlangen-Nuernberg, Lehrstuhl fuer Technische Physik, Erlangen (Germany); Krone, Julia [Technische Universitaet Chemnitz, Institut fuer Physik (Germany)

    2017-11-15

    Based on its electronic, structural, chemical, and mechanical properties, many potential applications have been proposed for graphene. In order to realize these visions, graphene has to be synthesized, grown, or exfoliated with properties that are determined by the targeted application. Growth of so-called epitaxial graphene on silicon carbide by sublimation of silicon in an argon atmosphere is one particular method that could potentially lead to electronic applications. In this contribution we summarize our recent work on different aspects of epitaxial graphene growth and interface manipulation by intercalation, which was performed by a combination of low-energy electron microscopy, low-energy electron diffraction, atomic force microscopy and photoelectron spectroscopy. (copyright 2017 by WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)