Sample records for partial equilibrium tables

  1. Investigation of CNTD Mechanism and its Effect on Microstructural Properties.

    DTIC Science & Technology

    1980-10-01

    Equilibrium Degree of Completion of SiCl4 Reduction 31 as a Function of Temperature, Pressure and Degree ofDilution. 9. Equilibrium Degree of Completion...Disproportionation Study with SiCl4 . A) 500/2500X B) 600/3000X 11. Morphology of Deposit Made in the Silicon Halide 39 Disproportionation Study with SiHCl 3. A...at a constant ratio of SiCl4 to NH 3 of 0.2 (except run #29, see Table A-1 Appendix I). The active gas partial pressure was calculated according to the

  2. Sparse Partial Equilibrium Tables in Chemically Resolved Reactive Flow

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Vitello, P; Fried, L E; Pudliner, B

    2003-07-14

    The detonation of an energetic material is the result of a complex interaction between kinetic chemical reactions and hydrodynamics. Unfortunately, little is known concerning the detailed chemical kinetics of detonations in energetic materials. CHEETAH uses rate laws to treat species with the slowest chemical reactions, while assuming other chemical species are in equilibrium. CHEETAH supports a wide range of elements and condensed detonation products and can also be applied to gas detonations. A sparse hash table of equation of state values, called the ''cache'' is used in CHEETAH to enhance the efficiency of kinetic reaction calculations. For large-scale parallel hydrodynamicmore » calculations, CHEETAH uses MPI communication to updates to the cache. We present here details of the sparse caching model used in the CHEETAH. To demonstrate the efficiency of modeling using a sparse cache model we consider detonations in energetic materials.« less

  3. Sparse Partial Equilibrium Tables in Chemically Resolved Reactive Flow

    NASA Astrophysics Data System (ADS)

    Vitello, Peter; Fried, Laurence E.; Pudliner, Brian; McAbee, Tom

    2004-07-01

    The detonation of an energetic material is the result of a complex interaction between kinetic chemical reactions and hydrodynamics. Unfortunately, little is known concerning the detailed chemical kinetics of detonations in energetic materials. CHEETAH uses rate laws to treat species with the slowest chemical reactions, while assuming other chemical species are in equilibrium. CHEETAH supports a wide range of elements and condensed detonation products and can also be applied to gas detonations. A sparse hash table of equation of state values is used in CHEETAH to enhance the efficiency of kinetic reaction calculations. For large-scale parallel hydrodynamic calculations, CHEETAH uses parallel communication to updates to the cache. We present here details of the sparse caching model used in the CHEETAH coupled to an ALE hydrocode. To demonstrate the efficiency of modeling using a sparse cache model we consider detonations in energetic materials.

  4. Study on hydraulic property models for water retention and unsaturated hydraulic conductivity in MATSIRO with representation of water table dynamics

    NASA Astrophysics Data System (ADS)

    Yoshida, N.; Oki, T.

    2016-12-01

    Appropriate initial condition of soil moisture and water table depth are important factors to reduce uncertainty in hydrological simulations. Approaches to determine the initial water table depth have been developed because of difficulty to get information on global water table depth and soil moisture distributions. However, how is equilibrium soil moisture determined by climate conditions? We try to discuss this issue by using land surface model with representation of water table dynamics (MAT-GW). First, the global pattern of water table depth at equilibrium soil moisture in MAT-GW was verified. The water table depth in MAT-GW was deeper than the previous one at fundamentally arid region because the negative recharge and continuous baseflow made water table depth deeper. It indicated that the hydraulic conductivity used for estimating recharge and baseflow need to be reassessed in MAT-GW. In soil physics field, it is revealed that proper hydraulic property models for water retention and unsaturated hydraulic conductivity should be selected for each soil type. So, the effect of selecting hydraulic property models on terrestrial soil moisture and water table depth were examined.Clapp and Hornburger equation(CH eq.) and Van Genuchten equation(VG eq.) were used as representative hydraulic property models. Those models were integrated on MAT-GW and equilibrium soil moisture and water table depth with using each model were compared. The water table depth and soil moisture at grids which reached equilibrium in both simulations were analyzed. The equilibrium water table depth were deeper in VG eq. than CH eq. in most grids due to shape of hydraulic property models. Then, total soil moisture were smaller in VG eq. than CH eq. at almost all grids which water table depth reached equilibrium. It is interesting that spatial patterns which water table depth reached equilibrium or not were basically similar in both simulations but reverse patterns were shown in east and west part of America. Selection of each hydraulic property model based on soil types may compensate characteristic of models in initialization.

  5. Discussion of enthalpy, entropy and free energy of formation of GaN

    NASA Astrophysics Data System (ADS)

    Jacob, K. T.; Rajitha, G.

    2009-07-01

    Presented in this letter is a critical discussion of a recent paper on experimental investigation of the enthalpy, entropy and free energy of formation of gallium nitride (GaN) published in this journal [T.J. Peshek, J.C. Angus, K. Kash, J. Cryst. Growth 311 (2008) 185-189]. It is shown that the experimental technique employed detects neither the equilibrium partial pressure of N 2 corresponding to the equilibrium between Ga and GaN at fixed temperatures nor the equilibrium temperature at constant pressure of N 2. The results of Peshek et al. are discussed in the light of other information on the Gibbs energy of formation available in the literature. Entropy of GaN is derived from heat-capacity measurements. Based on a critical analysis of all thermodynamic information now available, a set of optimized parameters is identified and a table of thermodynamic data for GaN developed from 298.15 to 1400 K.

  6. Use of JANAF Tables in Equilibrium Calculations and Partition Function Calculations for an Undergraduate Physical Chemistry Course

    ERIC Educational Resources Information Center

    Cleary, David A.

    2014-01-01

    The usefulness of the JANAF tables is demonstrated with specific equilibrium calculations. An emphasis is placed on the nature of standard chemical potential calculations. Also, the use of the JANAF tables for calculating partition functions is examined. In the partition function calculations, the importance of the zero of energy is highlighted.

  7. Exploring Chemical Equilibrium with Poker Chips: A General Chemistry Laboratory Exercise

    ERIC Educational Resources Information Center

    Bindel, Thomas H.

    2012-01-01

    A hands-on laboratory exercise at the general chemistry level introduces students to chemical equilibrium through a simulation that uses poker chips and rate equations. More specifically, the exercise allows students to explore reaction tables, dynamic chemical equilibrium, equilibrium constant expressions, and the equilibrium constant based on…

  8. Methane on Mars: Thermodynamic Equilibrium and Photochemical Calculations

    NASA Technical Reports Server (NTRS)

    Levine, J. S.; Summers, M. E.; Ewell, M.

    2010-01-01

    The detection of methane (CH4) in the atmosphere of Mars by Mars Express and Earth-based spectroscopy is very surprising, very puzzling, and very intriguing. On Earth, about 90% of atmospheric ozone is produced by living systems. A major question concerning methane on Mars is its origin - biological or geological. Thermodynamic equilibrium calculations indicated that methane cannot be produced by atmospheric chemical/photochemical reactions. Thermodynamic equilibrium calculations for three gases, methane, ammonia (NH3) and nitrous oxide (N2O) in the Earth s atmosphere are summarized in Table 1. The calculations indicate that these three gases should not exist in the Earth s atmosphere. Yet they do, with methane, ammonia and nitrous oxide enhanced 139, 50 and 12 orders of magnitude above their calculated thermodynamic equilibrium concentration due to the impact of life! Thermodynamic equilibrium calculations have been performed for the same three gases in the atmosphere of Mars based on the assumed composition of the Mars atmosphere shown in Table 2. The calculated thermodynamic equilibrium concentrations of the same three gases in the atmosphere of Mars is shown in Table 3. Clearly, based on thermodynamic equilibrium calculations, methane should not be present in the atmosphere of Mars, but it is in concentrations approaching 30 ppbv from three distinct regions on Mars.

  9. Incorporating water table dynamics in climate modeling: 1. Water table observations and equilibrium water table simulations

    NASA Astrophysics Data System (ADS)

    Fan, Ying; Miguez-Macho, Gonzalo; Weaver, Christopher P.; Walko, Robert; Robock, Alan

    2007-05-01

    Soil moisture is a key participant in land-atmosphere interactions and an important determinant of terrestrial climate. In regions where the water table is shallow, soil moisture is coupled to the water table. This paper is the first of a two-part study to quantify this coupling and explore its implications in the context of climate modeling. We examine the observed water table depth in the lower 48 states of the United States in search of salient spatial and temporal features that are relevant to climate dynamics. As a means to interpolate and synthesize the scattered observations, we use a simple two-dimensional groundwater flow model to construct an equilibrium water table as a result of long-term climatic and geologic forcing. Model simulations suggest that the water table depth exhibits spatial organization at watershed, regional, and continental scales, which may have implications for the spatial organization of soil moisture at similar scales. The observations suggest that water table depth varies at diurnal, event, seasonal, and interannual scales, which may have implications for soil moisture memory at these scales.

  10. Along-strike variability of primitive magmas (major and volatile elements) inferred from olivine-hosted melt inclusions, southernmost Andean Southern Volcanic Zone, Chile

    NASA Astrophysics Data System (ADS)

    Weller, D. J.; Stern, C. R.

    2018-01-01

    Glass compositions of melt inclusions in olivine phenocrysts found in tephras derived from explosive eruptions of the four volcanoes along the volcanic front of the southernmost Andean Southern Volcanic Zone (SSVZ) are used to constrain primitive magma compositions and melt generation parameters. Primitive magmas from Hudson, Macá, and Melimoyu have similar compositions and are formed by low degrees (8-18%) of partial melting. Compared to these other three centers, primitive magmas from Mentolat have higher Al2O3 and lower MgO, TiO2 and other incompatible minor elements, and are generated by somewhat higher degrees (12-20%) of partial melting. The differences in the estimated primitive parental magma compositions between Mentolat and the other three volcanic centers are consistent with difference in the more evolved magmas erupted from these centers, Mentolat magmas having higher Al2O3 and lower MgO, TiO2 and other incompatible minor element contents, suggesting that these differences are controlled by melting processes in the mantle source region above the subducted oceanic plate. Parental magma S = 1430-594 and Cl = 777-125 (μg/g) contents of Hudson, Macá, and Melimoyu are similar to other volcanoes further north in the SVZ. However, Mentolat primitive magmas have notably higher concentrations of S = 2656-1227 and Cl = 1078-704 (μg/g). The observed along-arc changes in parental magma chemistry may be due to the close proximity below Mentolat of the subducted Guamblin Fracture Zone that could efficiently transport hydrous mineral phases, seawater, and sediment into the mantle, driving enhanced volatile fluxed melting beneath this center compared to the others. Table S2. Olivine-hosted melt inclusion compositions, host-olivine compositions, and the post-entrapment crystallization corrected melt inclusion compositions. Table S3. Olivine-hosted melt inclusion modeling information. Table S4. Major element compositions of the fractionation corrected melt inclusion in equilibrium with mantle olivine. Table S5. Melting parameters Fm and CoH2O. Table S6. Major element compositions of phenocrysts and glasses occurring with the olivine-hosted melt inclusions.

  11. 40 CFR Table 8 to Subpart Ffff of... - Partially Soluble Hazardous Air Pollutants

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... CATEGORIES (CONTINUED) National Emission Standards for Hazardous Air Pollutants: Miscellaneous Organic Chemical Manufacturing Pt. 63, Subpt. FFFF, Table 8 Table 8 to Subpart FFFF of Part 63—Partially Soluble...: Chemical name . . . CAS No. 1. 1,1,1-Trichloroethane (methyl chloroform) 71556 2. 1,1,2,2-Tetrachloroethane...

  12. Chemical equilibrium. [maximizing entropy of gas system to derive relations between thermodynamic variables

    NASA Technical Reports Server (NTRS)

    1976-01-01

    The entropy of a gas system with the number of particles subject to external control is maximized to derive relations between the thermodynamic variables that obtain at equilibrium. These relations are described in terms of the chemical potential, defined as equivalent partial derivatives of entropy, energy, enthalpy, free energy, or free enthalpy. At equilibrium, the change in total chemical potential must vanish. This fact is used to derive the equilibrium constants for chemical reactions in terms of the partition functions of the species involved in the reaction. Thus the equilibrium constants can be determined accurately, just as other thermodynamic properties, from a knowledge of the energy levels and degeneracies for the gas species involved. These equilibrium constants permit one to calculate the equilibrium concentrations or partial pressures of chemically reacting species that occur in gas mixtures at any given condition of pressure and temperature or volume and temperature.

  13. Non-equilibrium condensation of supercritical carbon dioxide in a converging-diverging nozzle

    NASA Astrophysics Data System (ADS)

    Ameli, Alireza; Afzalifar, Ali; Turunen-Saaresti, Teemu

    2017-03-01

    Carbon dioxide (CO2) is a promising alternative as a working fluid for future energy conversion and refrigeration cycles. CO2 has low global warming potential compared to refrigerants and supercritical CO2 Brayton cycle ought to have better efficiency than today’s counter parts. However, there are several issues concerning behaviour of supercritical CO2 in aforementioned applications. One of these issues arises due to non-equilibrium condensation of CO2 for some operating conditions in supercritical compressors. This paper investigates the non-equilibrium condensation of carbon dioxide in the course of an expansion from supercritical stagnation conditions in a converging-diverging nozzle. An external look-up table was implemented, using an in-house FORTRAN code, to calculate the fluid properties in supercritical, metastable and saturated regions. This look-up table is coupled with the flow solver and the non-equilibrium condensation model is introduced to the solver using user defined expressions. Numerical results are compared with the experimental measurements. In agreement with the experiment, the distribution of Mach number in the nozzle shows that the flow becomes supersonic in upstream region near the throat where speed of sound is minimum also the equilibrium reestablishment occurs at the outlet boundary condition.

  14. Symmetric Decomposition of Asymmetric Games.

    PubMed

    Tuyls, Karl; Pérolat, Julien; Lanctot, Marc; Ostrovski, Georg; Savani, Rahul; Leibo, Joel Z; Ord, Toby; Graepel, Thore; Legg, Shane

    2018-01-17

    We introduce new theoretical insights into two-population asymmetric games allowing for an elegant symmetric decomposition into two single population symmetric games. Specifically, we show how an asymmetric bimatrix game (A,B) can be decomposed into its symmetric counterparts by envisioning and investigating the payoff tables (A and B) that constitute the asymmetric game, as two independent, single population, symmetric games. We reveal several surprising formal relationships between an asymmetric two-population game and its symmetric single population counterparts, which facilitate a convenient analysis of the original asymmetric game due to the dimensionality reduction of the decomposition. The main finding reveals that if (x,y) is a Nash equilibrium of an asymmetric game (A,B), this implies that y is a Nash equilibrium of the symmetric counterpart game determined by payoff table A, and x is a Nash equilibrium of the symmetric counterpart game determined by payoff table B. Also the reverse holds and combinations of Nash equilibria of the counterpart games form Nash equilibria of the asymmetric game. We illustrate how these formal relationships aid in identifying and analysing the Nash structure of asymmetric games, by examining the evolutionary dynamics of the simpler counterpart games in several canonical examples.

  15. Combustion gas properties. 2: Natural gas fuel and dry air

    NASA Technical Reports Server (NTRS)

    Wear, J. D.; Jones, R. E.; Trout, A. M.; Mcbride, B. J.

    1985-01-01

    A series of computations has been made to produce the equilibrium temperature and gas composition for natural gas fuel and dry air. The computed tables and figures provide combustion gas property data for pressures from 0.5 to 50 atmospheres and equivalence ratios from 0 to 2.0. Only samples tables and figures are provided in this report. The complete set of tables and figures is provided on four microfiche films supplied with this report.

  16. An equation of state for partially ionized plasmas: The Coulomb contribution to the free energy

    NASA Astrophysics Data System (ADS)

    Kilcrease, D. P.; Colgan, J.; Hakel, P.; Fontes, C. J.; Sherrill, M. E.

    2015-09-01

    We have previously developed an equation of state (EOS) model called ChemEOS (Hakel and Kilcrease, Atomic Processes in Plasmas, Eds., J. Cohen et al., AIP, 2004) for a plasma of interacting ions, atoms and electrons. It is based on a chemical picture of the plasma and is derived from an expression for the Helmholtz free energy of the interacting species. All other equilibrium thermodynamic quantities are then obtained by minimizing this free energy subject to constraints, thus leading to a thermodynamically consistent EOS. The contribution to this free energy from the Coulomb interactions among the particles is treated using the method of Chabrier and Potekhin (Phys. Rev. E 58, 4941 (1998)) which we have adapted for partially ionized plasmas. This treatment is further examined and is found to give rise to unphysical behavior for various elements at certain values of the density and temperature where the Coulomb coupling begins to become significant and the atoms are partially ionized. We examine the source of this unphysical behavior and suggest corrections that produce acceptable results. The sensitivity of the thermodynamic properties and frequency-dependent opacity of iron is examined with and without these corrections. The corrected EOS is used to determine the fractional ion populations and level populations for a new generation of OPLIB low-Z opacity tables currently being prepared at Los Alamos National Laboratory with the ATOMIC code.

  17. STREAM Table Program: User's manual and program document

    NASA Technical Reports Server (NTRS)

    Hiles, K. H.

    1981-01-01

    This program was designed to be an editor for the Lewis Chemical Equilibrium program input files and is used for storage, manipulation and retrieval of the large amount of data required. The files are based on the facility name, case number, and table number. The data is easily recalled by supplying the sheet number to be displayed. The retrieval basis is a sheet defined to be all of the individual flow streams which comprise a given portion of a coal gasification system. A sheet may cover more than one page of output tables. The program allows for the insertion of a new table, revision of existing tables, deletion of existing tables, or the printing of selected tables. No calculations are performed. Only pointers are used to keep track of the data.

  18. Analysis of Multiple Contingency Tables by Exact Conditional Tests for Zero Partial Association.

    ERIC Educational Resources Information Center

    Kreiner, Svend

    The tests for zero partial association in a multiple contingency table have gained new importance with the introduction of graphical models. It is shown how these may be performed as exact conditional tests, using as test criteria either the ordinary likelihood ratio, the standard x squared statistic, or any other appropriate statistics. A…

  19. Abundances of Jupiter's Trace Hydrocarbons from Voyager and Cassini. Data Tables: Cassini CIRS Observations Planetary and Space Science, Forthcoming 2010

    NASA Technical Reports Server (NTRS)

    Nixon, C. A.; Achterberg, R. K.; Romani, P. N.; Allen, M.; Zhang, X.; Teanby, N. A.; Irwin, P. G. J.; Flasar, F. M.

    2010-01-01

    The following six tables give the retrieved temperatures and volume mixing ratios of C2H2 and C2H6 and the formal errors on these results from the retrieval, as described in the manuscript. These are in the form of two-dimensional tables, specified on a latitudinal and vertical grid. The first column is the pressure in bar, and the second column gives the altitude in kilometers calculated from hydrostatic equilibrium, and applies to the equatorial profile only. The top row of the table specifies the planetographic latitude.

  20. Abundances of Jupiter's Trace Hydrocarbons from Voyager and Cassini. Data Tables: Voyager IRIS Observations Planetary and Space Science, Forthcoming 2010

    NASA Technical Reports Server (NTRS)

    Nixon, C. A.; Achterberg, R. K.; Romani, P. N.; Allen, M.; Zhang, X.; Irwin, P. G. J.; Flasar, F. M.

    2010-01-01

    The following six tables give the retrieved temperatures and volume mixing ratios of C2H2 and C2H6 and the formal errors on these results from the retrieval, as described in the manuscript. These are in the form of two-dimensional tables, specified on a latitudinal and vertical grid. The first column is the pressure in bar, and the second column gives the altitude in kilometers calculated from hydrostatic equilibrium, and applies to the equatorial profile only. The top row of the table specifies the planetographic latitude.

  1. Equivalence of equations describing trace element distribution during equilibrium partial melting

    NASA Technical Reports Server (NTRS)

    Consolmagno, G. J.; Drake, M. J.

    1976-01-01

    It is shown that four equations used for calculating the evolution of trace-element abundances during equilibrium partial melting are mathematically equivalent. The equations include those of Hertogen and Gijbels (1976), Shaw (1970), Schilling (1971), and O'Nions and Clarke (1972). The general form to which all these equations reduce is presented, and an analysis is performed to demonstrate their mathematical equivalence. It is noted that the utility of the general equation flows from the nature of equilibrium (i.e., the final state is independent of the path by which that state is attained).

  2. Thermodynamic properties of minerals

    USGS Publications Warehouse

    Robie, Richard A.

    1962-01-01

    In the ten years since the publication of the national Bureau of Standards comprehensive tables of thermochemical properties, by Rossini and other (1952), a very large body of modern calorimetric and equilibrium data has become available. Because of the complex interrelations among many thermochemical data and the necessity for internal consistency among these values, a complete revision of this standard reference is required. This is also true of the summaries of thermochemical data for the sulfides (Richardson and Jeffes 1952) and for the oxides (Coughlin 1954). The following tables present critically selected values for the heat and free energy of formation, the logarithm of the equilibrium constant of formation Log Kf, the entropy and the molar volume, at 298.15°K (25.0°C) and one atmosphere for minerals.

  3. Effects of aircraft noise on the equilibrium of airport residents: Testing and utilization of a new methodology

    NASA Technical Reports Server (NTRS)

    Francois, J.

    1981-01-01

    The focus of the investigation is centered around two main themes: an analysis of the effects of aircraft noise on the psychological and physiological equilibrium of airport residents; and an analysis of the sources of variability of sensitivity to noise. The methodology used is presented. Nine statistical tables are included, along with a set of conclusions.

  4. Analyzing the dependence of oxygen incorporation current density on overpotential and oxygen partial pressure in mixed conducting oxide electrodes.

    PubMed

    Guan, Zixuan; Chen, Di; Chueh, William C

    2017-08-30

    The oxygen incorporation reaction, which involves the transformation of an oxygen gas molecule to two lattice oxygen ions in a mixed ionic and electronic conducting solid, is a ubiquitous and fundamental reaction in solid-state electrochemistry. To understand the reaction pathway and to identify the rate-determining step, near-equilibrium measurements have been employed to quantify the exchange coefficients as a function of oxygen partial pressure and temperature. However, because the exchange coefficient contains contributions from both forward and reverse reaction rate constants and depends on both oxygen partial pressure and oxygen fugacity in the solid, unique and definitive mechanistic assessment has been challenging. In this work, we derive a current density equation as a function of both oxygen partial pressure and overpotential, and consider both near and far from equilibrium limits. Rather than considering specific reaction pathways, we generalize the multi-step oxygen incorporation reaction into the rate-determining step, preceding and following quasi-equilibrium steps, and consider the number of oxygen ions and electrons involved in each. By evaluating the dependence of current density on oxygen partial pressure and overpotential separately, one obtains the reaction orders for oxygen gas molecules and for solid-state species in the electrode. We simulated the oxygen incorporation current density-overpotential curves for praseodymium-doped ceria for various candidate rate-determining steps. This work highlights a promising method for studying the exchange kinetics far away from equilibrium.

  5. An equation of state for partially ionized plasmas: The Coulomb contribution to the free energy

    DOE PAGES

    Kilcrease, D. P.; Colgan, J.; Hakel, P.; ...

    2015-06-20

    We have previously developed an equation of state (EOS) model called ChemEOS (Hakel and Kilcrease, Atomic Processes in Plasmas, Eds., J. Cohen et al., AIP, 2004) for a plasma of interacting ions, atoms and electrons. It is based on a chemical picture of the plasma and is derived from an expression for the Helmholtz free energy of the interacting species. All other equilibrium thermodynamic quantities are then obtained by minimizing this free energy subject to constraints, thus leading to a thermodynamically consistent EOS. The contribution to this free energy from the Coulomb interactions among the particles is treated using themore » method of Chabrier and Potekhin (Phys. Rev. E 58, 4941 (1998)) which we have adapted for partially ionized plasmas. This treatment is further examined and is found to give rise to unphysical behavior for various elements at certain values of the density and temperature where the Coulomb coupling begins to become significant and the atoms are partially ionized. We examine the source of this unphysical behavior and suggest corrections that produce acceptable results. The sensitivity of the thermodynamic properties and frequency-dependent opacity of iron is examined with and without these corrections. Lastly, the corrected EOS is used to determine the fractional ion populations and level populations for a new generation of OPLIB low-Z opacity tables currently being prepared at Los Alamos National Laboratory with the ATOMIC code.« less

  6. Solubility of carbon dioxide in aqueous mixtures of alkanolamines

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Dawodu, O.F.; Meisen, A.

    1994-07-01

    The solubility of CO[sub 2] in water + N-methyldiethanolamine + monoethanolamine (MDEA + MEA) and water + N-methyldiethanolamine + diethanolamine (MDEA + DEA) are reported at two compositions of 3.4 M MDEA + 0.8 M MEA or DEA and 2.1 M MDEA + 2.1 M MEA or DEA at temperatures from 70 to 180 C and CO[sub 2] partial pressures from 100 to 3,850 kPa. The solubility of CO[sub 2] in the blends decreased with an increase in temperature but increased with an increase in CO[sub 2] partial pressure. At low partial pressures of CO[sub 2] and the same totalmore » amine concentration, the equilibrium CO[sub 2] loadings were in the order MDEA + MEA > MDEA + DEA > MDEA. However, at high CO[sub 2] partial pressures, the equilibrium CO[sub 2] loadings in the MDEA solutions were higher than those of the MDEA + MEA and MDEA + DEA blends of equal molar strengths due to the stoichiometric loading limitations of MEA and DEA. The nonadditivity of the equilibrium loadings for single amine systems highlights the need for independent measurements on amine blends.« less

  7. Computer Program for Calculation of Complex Chemical Equilibrium Compositions and Applications II. Users Manual and Program Description. 2; Users Manual and Program Description

    NASA Technical Reports Server (NTRS)

    McBride, Bonnie J.; Gordon, Sanford

    1996-01-01

    This users manual is the second part of a two-part report describing the NASA Lewis CEA (Chemical Equilibrium with Applications) program. The program obtains chemical equilibrium compositions of complex mixtures with applications to several types of problems. The topics presented in this manual are: (1) details for preparing input data sets; (2) a description of output tables for various types of problems; (3) the overall modular organization of the program with information on how to make modifications; (4) a description of the function of each subroutine; (5) error messages and their significance; and (6) a number of examples that illustrate various types of problems handled by CEA and that cover many of the options available in both input and output. Seven appendixes give information on the thermodynamic and thermal transport data used in CEA; some information on common variables used in or generated by the equilibrium module; and output tables for 14 example problems. The CEA program was written in ANSI standard FORTRAN 77. CEA should work on any system with sufficient storage. There are about 6300 lines in the source code, which uses about 225 kilobytes of memory. The compiled program takes about 975 kilobytes.

  8. 40 CFR Table 8 to Subpart Ffff of... - Partially Soluble Hazardous Air Pollutants

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... CATEGORIES National Emission Standards for Hazardous Air Pollutants: Miscellaneous Organic Chemical... and treatment requirements in this subpart FFFF are listed in the following table: Chemical name...

  9. Tables of model atmospheres of bursting neutron stars

    NASA Technical Reports Server (NTRS)

    Madej, Jerzy

    1991-01-01

    This paper presents tables of plane-parallel neutron star model atmospheres in radiative and hydrostatic equilibrium, with effective temperatures of 8 x 10 exp 6, 1.257 x 10 exp 7, 2 x 10 exp 7, and 3 x 10 exp 7 K, and surface gravities of 15.0 and less (cgs units). The equations of model atmospheres on which the tables are based fully account for nonisotropies of the radiation field and effects of noncoherent Compton scattering of thermal X-rays by free electrons. Both the effective temperatures and gravities listed above are measured on the neutron star surface.

  10. Hydrology and Alkalinity Regulation of Soft Florida Waters: An Integrated Assessment

    NASA Astrophysics Data System (ADS)

    Stauffer, Robert E.; Canfield, Daniel E., Jr.

    1992-06-01

    Natural waters in ridge provinces of Florida and southeast Georgia were classified geographically, by degrees of cultural disturbance, and according to the dominant hydrologic and biogeochemical processes controlling chemistry. The ionic composition of lakes, upland streams, and surficial aquifer (water table) springs in relatively undeveloped catchments reflects the geographic variations in bulk deposition corrected for evapotranspiration (Na, Cl), plus a slight gain (net watershed mobilization) of Mg, and partial to nearly complete losses (net retention) of nitrate, sulfate, Ca, and K. Recharge to the Floridan aquifer in infertile, forested, sandy ridge provinces of northern Florida contains 360-580 μmol CO2. On the basis of indirect geochemical evidence, sulfate retention appears less important in lake sediments than in the region's highly weathered, ferruginous, kaolinitic, sand soils. Silica concentrations in upland streams and water table springs closely reflect the predicted equilibrium between kaolinite and gibbsite. Along with other evidence, the Si concentrations in ridge lakes indicate that seepage inflow is much more important than assumed in Baker et al.'s (1988) regional model. Lakes and streams are acidified either by humic acids or nonmarine sulfate but rarely by both, as reflected by the significant inverse correlation between these two components. Contrary to previous reports, there is no significant difference in alkalinity for culturally undisturbed lakes in the northern Trail versus southern Highlands Ridge areas.

  11. H-division quarterly report, October--December 1977. [Lawrence Livermore Laboratory

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Not Available

    1978-02-10

    The Theoretical EOS Group develops theoretical techniques for describing material properties under extreme conditions and constructs equation-of-state (EOS) tables for specific applications. Work this quarter concentrated on a Li equation of state, equation of state for equilibrium plasma, improved ion corrections to the Thomas--Fermi--Kirzhnitz theory, and theoretical estimates of high-pressure melting in metals. The Experimental Physics Group investigates properties of materials at extreme conditions of pressure and temperature, and develops new experimental techniques. Effort this quarter concerned the following: parabolic projectile distortion in the two-state light-gas gun, construction of a ballistic range for long-rod penetrators, thermodynamics and sound velocities inmore » liquid metals, isobaric expansion measurements in Pt, and calculation of the velocity--mass profile of a jet produced by a shaped charge. Code development was concentrated on the PELE code, a multimaterial, multiphase, explicit finite-difference Eulerian code for pool suppression dynamics of a hypothetical loss-of-coolant accident in a nuclear reactor. Activities of the Fluid Dynamics Group were directed toward development of a code to compute the equations of state and transport properties of liquid metals (e.g. Li) and partially ionized dense plasmas, jet stability in the Li reactor system, and the study and problem application of fluid dynamic turbulence theory. 19 figures, 5 tables. (RWR)« less

  12. Numerical study of entropy generation and melting heat transfer on MHD generalised non-Newtonian fluid (GNF): Application to optimal energy

    NASA Astrophysics Data System (ADS)

    Iqbal, Z.; Mehmood, Zaffar; Ahmad, Bilal

    2018-05-01

    This paper concerns an application to optimal energy by incorporating thermal equilibrium on MHD-generalised non-Newtonian fluid model with melting heat effect. Highly nonlinear system of partial differential equations is simplified to a nonlinear system using boundary layer approach and similarity transformations. Numerical solutions of velocity and temperature profile are obtained by using shooting method. The contribution of entropy generation is appraised on thermal and fluid velocities. Physical features of relevant parameters have been discussed by plotting graphs and tables. Some noteworthy findings are: Prandtl number, power law index and Weissenberg number contribute in lowering mass boundary layer thickness and entropy effect and enlarging thermal boundary layer thickness. However, an increasing mass boundary layer effect is only due to melting heat parameter. Moreover, thermal boundary layers have same trend for all parameters, i.e., temperature enhances with increase in values of significant parameters. Similarly, Hartman and Weissenberg numbers enhance Bejan number.

  13. Partially wrong? Partial equilibrium and the economic analysis of public health emergencies of international concern.

    PubMed

    Beutels, P; Edmunds, W J; Smith, R D

    2008-11-01

    We argue that traditional health economic analysis is ill-equipped to estimate the cost effectiveness and cost benefit of interventions that aim at controlling and/or preventing public health emergencies of international concern (such as pandemic influenza or severe acute respiratory syndrome). The implicit assumption of partial equilibrium within both the health sector itself and--if a wider perspective is adopted--the economy as a whole would be violated by such emergencies. We propose an alternative, with the specific aim of accounting for the behavioural changes and capacity problems that are expected to occur when such an outbreak strikes. Copyright (c) 2008 John Wiley & Sons, Ltd.

  14. A Novel Method for Dynamic Short-Beam Shear Testing of 3D Woven Composites

    DTIC Science & Technology

    2011-08-11

    specimen was homogenized as an orthotropic elastic material with properties given in Table 1 [38]. The use of fully elastic model removes any material...impact event however after approximately 0.5 mm of deflection, equilibrium is reached. It is observed from Fig. 4(d) that equilibrium is never fully ...The public reporting burden for this collection of information is estimated to average 1 hour per response, including the time for reviewing

  15. Large Volume Non-Equilibrium Air Plasma at Atmospheric Pressure: A Novel Method with Low Power Requirements

    DTIC Science & Technology

    2007-02-28

    of magnitude in size. Also unlike corona -like devices such as the plasma needle , which generates 2-3 mm long plasma at the tip of a sharp wire...Distribution Unlimited Table of Contents Abstract AC System with Water Electrode Current voltage characteristics Plasma diagnostics results Experimental setup...Laroussi, PI. 4 AC SYSTEM WITH WATER ELECTRODE Recently, non-equilibrium atmospheric pressure plasmas have been used in a variety of material processing

  16. Partial Pressures of Te2 and Thermodynamic Properties of Ga-Te System

    NASA Technical Reports Server (NTRS)

    Su, Ching-Hua; Curreri, Peter A. (Technical Monitor)

    2001-01-01

    The partial pressures of Te2 in equilibrium with Ga(1-x)Te(x) samples were measured by optical absorption technique from 450 to 1100 C for compositions, x, between 0.333 and 0.612. To establish the relationship between the partial pressure of Te, and the measured optical absorbance, the calibration runs of a pure Te sample were also conducted to determine the Beer's Law constants. The partial pressures of Te2 in equilibrium with the GaTe(s) and Ga2Te3(s)compounds, or the so-called three-phase curves, were established. These partial pressure data imply the existence of the Ga3Te4(s) compound. From the partial pressures of Te2 over the Ga-Te melts, partial molar enthalpy and entropy of mixing for Te were derived and they agree reasonable well with the published data. The activities of Te in the Ga-Te melts were also derived from the measured partial pressures of Te2. These data agree well with most of the previous results. The possible reason for the high activity of Te measured for x less than 0.60 is discussed.

  17. A finite difference scheme for the equilibrium equations of elastic bodies

    NASA Technical Reports Server (NTRS)

    Phillips, T. N.; Rose, M. E.

    1984-01-01

    A compact difference scheme is described for treating the first-order system of partial differential equations which describe the equilibrium equations of an elastic body. An algebraic simplification enables the solution to be obtained by standard direct or iterative techniques.

  18. Imaging the equilibrium state and magnetization dynamics of partially built hard disk write heads

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Valkass, R. A. J., E-mail: rajv202@ex.ac.uk; Yu, W.; Shelford, L. R.

    Four different designs of partially built hard disk write heads with a yoke comprising four repeats of NiFe (1 nm)/CoFe (50 nm) were studied by both x-ray photoemission electron microscopy (XPEEM) and time-resolved scanning Kerr microscopy (TRSKM). These techniques were used to investigate the static equilibrium domain configuration and the magnetodynamic response across the entire structure, respectively. Simulations and previous TRSKM studies have made proposals for the equilibrium domain configuration of similar structures, but no direct observation of the equilibrium state of the writers has yet been made. In this study, static XPEEM images of the equilibrium state of writer structures weremore » acquired using x-ray magnetic circular dichroism as the contrast mechanism. These images suggest that the crystalline anisotropy dominates the equilibrium state domain configuration, but competition with shape anisotropy ultimately determines the stability of the equilibrium state. Dynamic TRSKM images were acquired from nominally identical devices. These images suggest that a longer confluence region may hinder flux conduction from the yoke into the pole tip: the shorter confluence region exhibits clear flux beaming along the symmetry axis, whereas the longer confluence region causes flux to conduct along one edge of the writer. The observed variations in dynamic response agree well with the differences in the equilibrium magnetization configuration visible in the XPEEM images, confirming that minor variations in the geometric design of the writer structure can have significant effects on the process of flux beaming.« less

  19. Thermodynamic and transport combustion properties of hydrocarbons with air. Part 2: Compositions corresponding to Kelvin temperature schedules in part 1

    NASA Technical Reports Server (NTRS)

    Gordon, S.

    1982-01-01

    The equilibrium compositions that correspond to the thermodynamic and transport combustion properties for a wide range of conditions for the reaction of hydrocarbons with air are presented. Initially 55 gaseous species and 3 coin condensed species were considered in the calculations. Only 17 of these 55 gaseous species had equilibrium mole fractions greater than 0.000005 for any of the conditions studied and therefore these were the only ones retained in the final tables.

  20. A Tightly Coupled Non-Equilibrium Magneto-Hydrodynamic Model for Inductively Coupled RF Plasmas

    DTIC Science & Technology

    2016-02-29

    development a tightly coupled magneto-hydrodynamic model for Inductively Coupled Radio- Frequency (RF) Plasmas. Non Local Thermodynamic Equilibrium (NLTE...for Inductively Coupled Radio-Frequency (RF) Plasmas. Non Local Thermodynamic Equilibrium (NLTE) effects are described based on a hybrid State-to-State... thermodynamic variable. This choice allows one to hide the non-linearity of the gas (total) thermal conductivity κ and can partially alle- 2 viate numerical

  1. Plasma Jet Interactions with Liquids in Partial Fulfillment of an NRL Karles Fellowship

    DTIC Science & Technology

    2015-11-30

    deposition), modify (e.g., chemical functionalization), and etch (in Si technology) materials. In low- pressure non- equilibrium discharge plasmas... equilibrium discharge plasmas, associated with the above processes, the electron population is much more energetic than both the ions and neutral gas...to be crucial to the advancements of these fields1, 2. Background: Atmospheric-pressure, non- equilibrium (APNE) plasmas, like low-pressure plasmas

  2. Metal-organic complexes in geochemical processes: Estimation of standard partial molal thermodynamic properties of aqueous complexes between metal cations and monovalent organic acid ligands at high pressures and temperatures

    NASA Astrophysics Data System (ADS)

    Shock, Everetr L.; Koretsky, Carla M.

    1995-04-01

    Regression of standard state equilibrium constants with the revised Helgeson-Kirkham-Flowers (HKF) equation of state allows evaluation of standard partial molal entropies ( overlineSo) of aqueous metal-organic complexes involving monovalent organic acid ligands. These values of overlineSo provide the basis for correlations that can be used, together with correlation algorithms among standard partial molal properties of aqueous complexes and equation-of-state parameters, to estimate thermodynamic properties including equilibrium constants for complexes between aqueous metals and several monovalent organic acid ligands at the elevated pressures and temperatures of many geochemical processes which involve aqueous solutions. Data, parameters, and estimates are given for 270 formate, propanoate, n-butanoate, n-pentanoate, glycolate, lactate, glycinate, and alanate complexes, and a consistent algorithm is provided for making other estimates. Standard partial molal entropies of association ( Δ -Sro) for metal-monovalent organic acid ligand complexes fall into at least two groups dependent upon the type of functional groups present in the ligand. It is shown that isothermal correlations among equilibrium constants for complex formation are consistent with one another and with similar correlations for inorganic metal-ligand complexes. Additional correlations allow estimates of standard partial molal Gibbs free energies of association at 25°C and 1 bar which can be used in cases where no experimentally derived values are available.

  3. Education Policy and Intergenerational Transfers in Equilibrium. NBER Working Paper No. 18782

    ERIC Educational Resources Information Center

    Abbott, Brant; Gallipoli, Giovanni; Meghir, Costas; Violante, Giovanni L.

    2013-01-01

    This paper compares partial and general equilibrium effects of alternative financial aid policies intended to promote college participation. We build an overlapping generations life-cycle, heterogeneous-agent, incomplete-markets model with education, labor supply, and consumption/saving decisions. Altruistic parents make inter vivos transfers to…

  4. Expedition 11 Preflight

    NASA Image and Video Library

    2005-04-10

    Expedition 11 Flight Engineer John Phillips takes part in a tilt table test, Monday, April 11, 2005, in Baikonur, Kazakhstan as technicians collect pre-launch data on the state of his equilibrium prior to the April 15 launch to the International Space Station. Photo Credit: (NASA/Bill Ingalls)

  5. Effects of sample size, number of markers, and allelic richness on the detection of spatial genetic pattern

    USGS Publications Warehouse

    Landguth, Erin L.; Gedy, Bradley C.; Oyler-McCance, Sara J.; Garey, Andrew L.; Emel, Sarah L.; Mumma, Matthew; Wagner, Helene H.; Fortin, Marie-Josée; Cushman, Samuel A.

    2012-01-01

    The influence of study design on the ability to detect the effects of landscape pattern on gene flow is one of the most pressing methodological gaps in landscape genetic research. To investigate the effect of study design on landscape genetics inference, we used a spatially-explicit, individual-based program to simulate gene flow in a spatially continuous population inhabiting a landscape with gradual spatial changes in resistance to movement. We simulated a wide range of combinations of number of loci, number of alleles per locus and number of individuals sampled from the population. We assessed how these three aspects of study design influenced the statistical power to successfully identify the generating process among competing hypotheses of isolation-by-distance, isolation-by-barrier, and isolation-by-landscape resistance using a causal modelling approach with partial Mantel tests. We modelled the statistical power to identify the generating process as a response surface for equilibrium and non-equilibrium conditions after introduction of isolation-by-landscape resistance. All three variables (loci, alleles and sampled individuals) affect the power of causal modelling, but to different degrees. Stronger partial Mantel r correlations between landscape distances and genetic distances were found when more loci were used and when loci were more variable, which makes comparisons of effect size between studies difficult. Number of individuals did not affect the accuracy through mean equilibrium partial Mantel r, but larger samples decreased the uncertainty (increasing the precision) of equilibrium partial Mantel r estimates. We conclude that amplifying more (and more variable) loci is likely to increase the power of landscape genetic inferences more than increasing number of individuals.

  6. Effects of sample size, number of markers, and allelic richness on the detection of spatial genetic pattern

    USGS Publications Warehouse

    Landguth, E.L.; Fedy, B.C.; Oyler-McCance, S.J.; Garey, A.L.; Emel, S.L.; Mumma, M.; Wagner, H.H.; Fortin, M.-J.; Cushman, S.A.

    2012-01-01

    The influence of study design on the ability to detect the effects of landscape pattern on gene flow is one of the most pressing methodological gaps in landscape genetic research. To investigate the effect of study design on landscape genetics inference, we used a spatially-explicit, individual-based program to simulate gene flow in a spatially continuous population inhabiting a landscape with gradual spatial changes in resistance to movement. We simulated a wide range of combinations of number of loci, number of alleles per locus and number of individuals sampled from the population. We assessed how these three aspects of study design influenced the statistical power to successfully identify the generating process among competing hypotheses of isolation-by-distance, isolation-by-barrier, and isolation-by-landscape resistance using a causal modelling approach with partial Mantel tests. We modelled the statistical power to identify the generating process as a response surface for equilibrium and non-equilibrium conditions after introduction of isolation-by-landscape resistance. All three variables (loci, alleles and sampled individuals) affect the power of causal modelling, but to different degrees. Stronger partial Mantel r correlations between landscape distances and genetic distances were found when more loci were used and when loci were more variable, which makes comparisons of effect size between studies difficult. Number of individuals did not affect the accuracy through mean equilibrium partial Mantel r, but larger samples decreased the uncertainty (increasing the precision) of equilibrium partial Mantel r estimates. We conclude that amplifying more (and more variable) loci is likely to increase the power of landscape genetic inferences more than increasing number of individuals. ?? 2011 Blackwell Publishing Ltd.

  7. Turbulent Coagulation of Particles Smaller Than the Length Scales of Turbulence and Equilibrium Sorption of Phenanthrene to Clay: Implications for Pollutant Transport in the Estuarine Water Column

    DTIC Science & Technology

    1997-05-01

    estuaries was modeled using phenanthrene, bacterial extracellular polymer and kaolinite clay as surrogates for a hydrophobic organic pollutant...coefficients obtained for phenanthrene sorption to kaolinite and bentonite in the presence of varying amounts of DOM represented by alginic acid and tannic...acid. 333 Table B.3: Literature values for sorption between phenanthrene, humic acid and kaolinite for [DOM]a = 10 mg/L 334 Table E.1: Sample output data

  8. Nonconvergence to Saddle Boundary Points under Perturbed Reinforcement Learning

    DTIC Science & Technology

    2012-12-07

    of the ODE (12). Note that for some games not all stationary points of the ODE (12) are Nash equilibria. For example, if you consider the Typewriter ...B A 4, 4 2, 2 B 2, 2 3, 3 Table 1: The Typewriter Game. On the other hand, any stationary point in the interior of the probability simplex will... Typewriter Game of Table 1. We observe that it is possible for the process to converge to a pure strategy profile which is not a Nash equilibrium when Ri(α

  9. The Art of the Lecture Revisited.

    ERIC Educational Resources Information Center

    Journal of Chemical Education, 1983

    1983-01-01

    Lecturing hints, periodic table, mechanistic approach to predicting inorganic reaction products for substitution reactions, reaction rates, spectroscopy, and entropy role change in establishing position of equilibrium for vaporization of water and synthesis of ammonia were topics of lectures presented at the Seventh Biennial Conference on Chemical…

  10. A Model for Siderophile Element Distribution in Planetary Differentiation

    NASA Technical Reports Server (NTRS)

    Humayun, M.; Rushmer, T.; Rankenburg, K.; Brandon, A. D.

    2005-01-01

    Planetary differentiation begins with partial melting of small planetesimals. At low degrees of partial melting, a sulfur-rich liquid segregates by physical mechanisms including deformation-assisted porous flow. Experimental studies of the physical mechanisms by which Fe-S melts segregate from the silicate matrix of a molten H chondrite are part of a companion paper. Geochemical studies of these experimental products revealed that metallic liquids were in equilibrium with residual metal in the H chondrite matrix. This contribution explores the geochemical signatures produced by early stages of core formation. Particularly, low-degree partial melt segregation of Fe-S liquids leaves residual metal in the silicate matrix. Some achondrites appear to be residues of partial melting, e.g., ureilites, which are known to contain metal. The metal in these achondrites may show a distinct elemental signature. To quantify the effect of sulfur on siderophile element contents of residual metal we have developed a model based on recent parametrizations of equilibrium solid metal-liquid metal partitioning experiments.

  11. Linkage Disequilibrium in a Finite Population That Is Partially Selfing

    PubMed Central

    Golding, G. B.; Strobeck, C.

    1980-01-01

    The linkage disequilibrium expected in a finite, partially selfing population is analyzed, assuming the infinite allele model. Formulas for the expected sum of squares of the linkage disequilibria and the squared standard linkage disequilibrium are derived from the equilibrium values of sixteen inbreeding coefficients required to describe the behavior of the system. These formulas are identical to those obtained with random mating if the effective population size Ne = (1-½S)N and the effective recombination value re = (1-S)r/(1-½S), where S is the proportion of selfing, are substituted for the population size and the recombination value. Therefore, the effect of partial selfing at equilibrium is to reduce the population size by a factor 1-½S and the recombination value by a factor (1-S)/(1-½S). PMID:17249017

  12. Improved resolution of single channel dwell times reveals mechanisms of binding, priming, and gating in muscle AChR

    PubMed Central

    Mukhtasimova, Nuriya; daCosta, Corrie J.B.

    2016-01-01

    The acetylcholine receptor (AChR) from vertebrate skeletal muscle initiates voluntary movement, and its kinetics of activation are crucial for maintaining the safety margin for neuromuscular transmission. Furthermore, the kinetic mechanism of the muscle AChR serves as an archetype for understanding activation mechanisms of related receptors from the Cys-loop superfamily. Here we record currents through single muscle AChR channels with improved temporal resolution approaching half an order of magnitude over our previous best. A range of concentrations of full and partial agonists are used to elicit currents from human wild-type and gain-of-function mutant AChRs. For each agonist–receptor combination, rate constants are estimated from maximum likelihood analysis using a kinetic scheme comprised of agonist binding, priming, and channel gating steps. The kinetic scheme and rate constants are tested by stochastic simulation, followed by incorporation of the experimental step response, sampling rate, background noise, and filter bandwidth. Analyses of the simulated data confirm all rate constants except those for channel gating, which are overestimated because of the established effect of noise on the briefest dwell times. Estimates of the gating rate constants were obtained through iterative simulation followed by kinetic fitting. The results reveal that the agonist association rate constants are independent of agonist occupancy but depend on receptor state, whereas those for agonist dissociation depend on occupancy but not on state. The priming rate and equilibrium constants increase with successive agonist occupancy, and for a full agonist, the forward rate constant increases more than the equilibrium constant; for a partial agonist, the forward rate and equilibrium constants increase equally. The gating rate and equilibrium constants also increase with successive agonist occupancy, but unlike priming, the equilibrium constants increase more than the forward rate constants. As observed for a full and a partial agonist, the gain-of-function mutation affects the relationship between rate and equilibrium constants for priming but not for channel gating. Thus, resolving brief single channel currents distinguishes priming from gating steps and reveals how the corresponding rate and equilibrium constants depend on agonist occupancy. PMID:27353445

  13. Index of stations: surface-water data-collection network of Texas, September 1998

    USGS Publications Warehouse

    Gandara, Susan C.; Barbie, Dana L.

    1999-01-01

    As of September 30, 1998, the surface-water data-collection network of Texas (table 1) included 313 continuous-recording streamflow stations (D), 22 gage-height record only stations (G), 23 crest-stage partial-record stations (C), 39 flood-hydrograph partial-record stations (H), 25 low-flow partial-record stations (L), 1 continuous-recording temperature station (M1), 25 continuous-recording temperature and conductivity stations (M2), 3 continuous-recording temperature, conductivity, and dissolved oxygen stations (M3), 13 continuous-recording temperature, conductivity, dissolved oxygen, and pH stations (M4), 5 daily chemical-quality stations (Qd), 133 periodic chemical-quality stations (Qp), 16 reservoir/lake surveys for water quality (Qs), and 70 continuous or daily reservoir-content stations (R). Plate 1 identifies the major river basins in Texas and shows the location of the stations listed in table 1.

  14. IRREVERSIBLE PROCESSES IN A PLASMA

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Balescu, R.

    1959-04-01

    ABS>The characteristic divergences caused by long-range phenomena in gases can be eliminated in equilibrium situations by partial summations of terms individually divergent but whose sum converges. It is shown how the recently developed diagram technique enables treatment of non-equilibrium cases by a rigorous asymptotic method. The general ideas underlying the approach are briefly indicated. (T.R. H.)

  15. Steam tables for pure water as an ActiveX component in Visual Basic 6.0

    NASA Astrophysics Data System (ADS)

    Verma, Mahendra P.

    2003-11-01

    The IAPWS-95 formulation for the thermodynamic properties of pure water was implemented as an ActiveX component ( SteamTables) in Visual Basic 6.0. For input parameters as temperature ( T=190-2000 K) and pressure ( P=3.23×10 -8-10,000 MPa) the program SteamTables calculates the following properties: volume ( V), density ( D), compressibility factor ( Z0), internal energy ( U), enthalpy ( H), Gibbs free energy ( G), Helmholtz free energy ( A), entropy ( S), heat capacity at constant pressure ( Cp), heat capacity at constant volume ( Cv), coefficient of thermal expansion ( CTE), isothermal compressibility ( Ziso), velocity of sound ( VelS), partial derivative of P with T at constant V (d Pd T), partial derivative of T with V at constant P (d Td V), partial derivative of V with P at constant T (d Vd P), Joule-Thomson coefficient ( JTC), isothermal throttling coefficient ( IJTC), viscosity ( Vis), thermal conductivity ( ThrmCond), surface tension ( SurfTen), Prandtl number ( PrdNum) and dielectric constant ( DielCons) for the liquid and vapor phases of pure water. It also calculates T as a function of P (or P as a function of T) along the sublimation, saturation and critical isochor curves, depending on the values of P (or T). The SteamTables can be incorporated in a program in any computer language, which supports object link embedding (OLE) in the Windows environment. An application of SteamTables is illustrated in a program in Visual Basic 6.0 to tabulate the values of the thermodynamic properties of water and vapor. Similarly, four functions, Temperature(Press), Pressure(Temp), State(Temp, Press) and WtrStmTbls(Temp, Press, Nphs, Nprop), where Temp, Press, Nphs and Nprop are temperature, pressure, phase number and property number, respectively, are written in Visual Basic for Applications (VBA) to use the SteamTables in a workbook in MS-Excel.

  16. Data of continuous harvest of stem cells via partial detachment from thermoresponsive nanobrush surfaces

    PubMed Central

    Yeh, Chin-Chen; Muduli, Saradaprasan; Peng, I-Chia; Lu, Yi-Tung; Ling, Qing-Dong; Alarfaj, Abdullah A.; Munusamy, Murugan A.; Kumar, S. Suresh; Murugan, Kadarkarai; Chen, Da-Chung; Lee, Hsin-chung; Chang, Yung; Higuchi, Akon

    2016-01-01

    This data article contains two figures and one table supporting the research article entitled: “Continuous harvest of stem cells via partial detachment from thermoresponsive nanobrush surface” [1]. The table shows coating conditions of three copolymers, poly(styrene-co-acrylic acid) grafted with oligovitronectin, poly(styrene-co-N-isopropylacrylamide) and poly(styrene-co-polyethylene glycol methacrylate) to prepare thermoresponsive surface. XPS spectra show the nitrogen peak of the polystyrene surface coated with poly(styrene-co-acrylic acid) grafted with oligovitronectin. The surface coating density analyzed from sorption of poly(styrene-co-acrylic acid) grafted with oligovitronectin by UV–vis spectroscopy is also presented. PMID:26909373

  17. Combustion Gas Properties I-ASTM Jet a Fuel and Dry Air

    NASA Technical Reports Server (NTRS)

    Jones, R. E.; Trout, A. M.; Wear, J. D.; Mcbride, B. J.

    1984-01-01

    A series of computations was made to produce the equilibrium temperature and gas composition for ASTM jet A fuel and dry air. The computed tables and figures provide combustion gas property data for pressures from 0.5 to 50 atmospheres and equivalence ratios from 0 to 2.0.

  18. A defect model for UO2+x based on electrical conductivity and deviation from stoichiometry measurements

    NASA Astrophysics Data System (ADS)

    Garcia, Philippe; Pizzi, Elisabetta; Dorado, Boris; Andersson, David; Crocombette, Jean-Paul; Martial, Chantal; Baldinozzi, Guido; Siméone, David; Maillard, Serge; Martin, Guillaume

    2017-10-01

    Electrical conductivity of UO2+x shows a strong dependence upon oxygen partial pressure and temperature which may be interpreted in terms of prevailing point defects. A simulation of this property along with deviation from stoichiometry is carried out based on a model that takes into account the presence of impurities, oxygen interstitials, oxygen vacancies, holes, electrons and clusters of oxygen atoms. The equilibrium constants for each defect reaction are determined to reproduce the experimental data. An estimate of defect concentrations and their dependence upon oxygen partial pressure can then be determined. The simulations carried out for 8 different temperatures (973-1673 K) over a wide range of oxygen partial pressures are discussed and resulting defect equilibrium constants are plotted in an Arrhenius diagram. This provides an estimate of defect formation energies which may further be compared to other experimental data or ab-initio and empirical potential calculations.

  19. Putting A Human Face on Equilibrium

    NASA Astrophysics Data System (ADS)

    Glickstein, Neil

    2005-03-01

    A short biography of chemist Fritz Haber is used to personalize the abstract concepts of equilibrium chemistry for high school students in an introductory course. In addition to giving the Haber Bosch process an historic, an economic, and a scientific background the reading and subsequent discussion allows students for whom the human perspective is of paramount importance a chance to investigate the irony of balance or equilibrium in Haber's life story. Since the inclusion of the Haber biography, performance in the laboratory and on examinations for those students who are usually only partially engaged has dramatically improved.

  20. Parts, Materials, and Processes Control Program for Expendable Launch Vehicles

    DTIC Science & Technology

    2015-05-21

    CSAM, thermal shock, voltage burn-in, electrical tests (DWV, room and hot IR, partial discharge when in corona region); perform DPA with SEM/EDX...controls to eliminate dielectric defects; proper voltage derating. Partial discharge testing, corona inception testing up to 60% of rated voltage...voltage burn-in; DWV; room and hot IR; life test; partial discharge when in corona region B-7 Table B-5. Metallized Plastic Capacitors

  1. The magmatic evolution and genesis of the Quaternary basanite-trachyphonolite suite of Itasy (Madagascar) as inferred by geochemistry, Sr-Nd-Pb isotopes and trace element distribution in coexisting phases

    NASA Astrophysics Data System (ADS)

    Melluso, L.; Tucker, R. D.; Cucciniello, C.; le Roex, A. P.; Morra, V.; Zanetti, A.; Rakotoson, R. L.

    2018-06-01

    The Itasy is a Pleistocene-Holocene volcanic field in central Madagascar, located to the west of the Ankaratra volcanic complex. It comprises scoria cones and lava domes (>120), with associated pyroclastic fall and mafic lava flows, covering an area of ab. 400 km2. The last volcanic episodes probably dated ca. 6000-7100 y BP; warm springs and geysers are active. The juvenile samples comprise a peculiar, almost bimodal, rock suite ranging from potassic leucite-kaersutite-bearing basanites, tephrites and phonotephrites, to benmoreites and titanite-haüyne-bearing trachyphonolites (MgO from 9-10 wt% to 0.1 wt%). These rocks show continuous and overlapping variations in the bulk-rock and phase composition (olivine, clinopyroxene, amphibole, feldspar, leucite, haüyne, nepheline, oxides, apatite, titanite, glass and other accessories). The basanites have homogeneous isotopic composition (87Sr/86Sr = 0.70366-0.70378, 143Nd/144Nd = 0.51274-0.51277, 206Pb/204Pb = 18.7-18.9, 207Pb/204Pb = 15.53-15.56; 208Pb/204Pb = 38.89-39.01), and a marked enrichment in the most incompatible elements (LILE and HFSE reach 100-215 times primitive mantle). These features are consistent with low degrees of partial melting of a volatile-, LILE- and HFSE-rich, amphibole-bearing peridotitic mantle induced by uplift during an E-W-directed extensional regime, as is found in central Madagascar. The marked changes in the geochemical composition, and small variations of the Sr-Nd-Pb isotopes in the trachyphonolites (87Sr/86Sr = 0.70425-0.70446, 143Nd/144Nd = 0.51266-0.51269, 206Pb/204Pb = 18.18-18.39, 207Pb/204Pb = 15.49-15.51; 208Pb/204Pb = 38.38-39.57) with respect to basanites and tephrites point to a limited amount of crustal contamination by the relatively low-206Pb/204Pb, low-143Nd/144Nd, high-87Sr/86Sr Precambrian basement rocks (of Middle Archean to Late Proterozoic age), and highlight the geochemical effects of titanite and anorthoclase removal on the trace element fractionation trends, a feature also shown in the trace element composition of the phenocrysts in trachyphonolites. Supplementary Table S2: synopsis of the mineral assemblages of the main lithotypes of the Itasy complex. Supplementary Table S3: composition of olivine of the Itasy rocks. Supplementary Table S4: composition of oxides of the Itasy rocks. Supplementary Table S5: composition of pyroxene of the Itasy rocks. Supplementary Table S6: composition of amphibole, biotite and rhönite of the Itasy rocks. Supplementary Table S7: composition of feldspar and glass of the Itasy rocks. Supplementary Table S8: composition of feldspathoids of the Itasy rocks. Supplementary Table S9: composition of titanite, apatite, other accessories of the Itasy rocks. Supplementary Table S10: Recapitulation of mass balance calculations between rocks of different degree of magmatic evolution, and detailed results. The composition of the phases is reported in the supplementary tables. Supplementary Table S11: average REE mineral/bulk rock ratios for titanite, amphibole and clinopyroxene. The partition coefficients of titanite, clinopyroxene, apatite and amphibole are taken from Olin and Wolff (2012), Fedele et al. (2009, 2015) and Tiepolo et al. (2007). Note that amphibole of RT-06I-355 could not be considered in equilibrium with the host rock (cf. Supplementary Figs. S1a, S1b, S1c).

  2. Interpreting equilibrium-conductivity and conductivity-relaxation measurements to establish thermodynamic and transport properties for multiple charged defect conducting ceramics.

    PubMed

    Zhu, Huayang; Ricote, Sandrine; Coors, W Grover; Kee, Robert J

    2015-01-01

    A model-based interpretation of measured equilibrium conductivity and conductivity relaxation is developed to establish thermodynamic, transport, and kinetics parameters for multiple charged defect conducting (MCDC) ceramic materials. The present study focuses on 10% yttrium-doped barium zirconate (BZY10). In principle, using the Nernst-Einstein relationship, equilibrium conductivity measurements are sufficient to establish thermodynamic and transport properties. However, in practice it is difficult to establish unique sets of properties using equilibrium conductivity alone. Combining equilibrium and conductivity-relaxation measurements serves to significantly improve the quantitative fidelity of the derived material properties. The models are developed using a Nernst-Planck-Poisson (NPP) formulation, which enables the quantitative representation of conductivity relaxations caused by very large changes in oxygen partial pressure.

  3. Ab initio investigation of the thermodynamics of cation distribution and of the electronic and magnetic structures in the LiMn2O4 spinel

    NASA Astrophysics Data System (ADS)

    Santos-Carballal, David; Ngoepe, Phuti E.; de Leeuw, Nora H.

    2018-02-01

    The spinel-structured lithium manganese oxide (LiMn2O4 ) is a material currently used as cathode for secondary lithium-ion batteries, but whose properties are not yet fully understood. Here, we report a computational investigation of the inversion thermodynamics and electronic behavior of LiMn2O4 derived from spin-polarized density functional theory calculations with a Hubbard Hamiltonian and long-range dispersion corrections (DFT+U-D3). Based on the analysis of the configurational free energy, we have elucidated a partially inverse equilibrium cation distribution for the LiMn2O4 spinel. This equilibrium degree of inversion is rationalized in terms of the crystal field stabilization effects and the difference between the size of the cations. We compare the atomic charges with the oxidation numbers for each degree of inversion. We found segregation of the Mn charge once these ions occupy the tetrahedral and octahedral sites of the spinel. We have obtained the atomic projections of the electronic band structure and density of states, showing that the normal LiMn2O4 has half-metallic properties, while the fully inverse spinel is an insulator. This material is in the ferrimagnetic state for the inverse and partially inverse cation arrangement. The optimized lattice and oxygen parameters, as well as the equilibrium degree of inversion, are in agreement with the available experimental data. The partial equilibrium degree of inversion is important in the interpretation of the lithium ion migration and surface properties of the LiMn2O4 spinel.

  4. Thermal non-equilibrium in porous medium adjacent to vertical plate: ANN approach

    NASA Astrophysics Data System (ADS)

    Ahmed, N. J. Salman; Ahamed, K. S. Nazim; Al-Rashed, Abdullah A. A. A.; Kamangar, Sarfaraz; Athani, Abdulgaphur

    2018-05-01

    Thermal non-equilibrium in porous medium is a condition that refers to temperature discrepancy in solid matrix and fluid of porous medium. This type of flow is complex flow requiring complex set of partial differential equations that govern the flow behavior. The current work is undertaken to predict the thermal non-equilibrium behavior of porous medium adjacent to vertical plate using artificial neural network. A set of neurons in 3 layers are trained to predict the heat transfer characteristics. It is found that the thermal non-equilibrium heat transfer behavior in terms of Nusselt number of fluid as well as solid phase can be predicted accurately by using well-trained neural network.

  5. Non-equilibrium Properties of a Pumped-Decaying Bose-Condensed Electron–Hole Gas in the BCS–BEC Crossover Region

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Hanai, R.; Littlewood, P. B.; Ohashi, Y.

    2016-03-01

    We theoretically investigate a Bose-condensed exciton gas out of equilibrium. Within the framework of the combined BCS-Leggett strong-coupling theory with the non-equilibrium Keldysh formalism, we show how the Bose-Einstein condensation (BEC) of excitons is suppressed to eventually disappear, when the system is in the non-equilibrium steady state. The supply of electrons and holes from the bath is shown to induce quasi-particle excitations, leading to the partial occupation of the upper branch of Bogoliubov single-particle excitation spectrum. We also discuss how this quasi-particle induction is related to the suppression of exciton BEC, as well as the stability of the steady state.

  6. Advanced classical thermodynamics

    NASA Astrophysics Data System (ADS)

    Emanuel, George

    The theoretical and mathematical foundations of thermodynamics are presented in an advanced text intended for graduate engineering students. Chapters are devoted to definitions and postulates, the fundamental equation, equilibrium, the application of Jacobian theory to thermodynamics, the Maxwell equations, stability, the theory of real gases, critical-point theory, and chemical thermodynamics. Diagrams, graphs, tables, and sample problems are provided.

  7. Variable-Position Acoustic Levitation

    NASA Technical Reports Server (NTRS)

    Barmatz, M. B.; Stoneburner, J. D.; Jacobi, N.; Wang, T. G.

    1983-01-01

    Method of acoustic levitation supports objects at positions other than acoustic nodes. Acoustic force is varied so it balances gravitational (or other) force, thereby maintaining object at any position within equilibrium range. Levitation method applicable to containerless processing. Such objects as table-tennis balls, hollow plastic spheres, and balsa-wood spheres levitated in laboratory by new method.

  8. A Computer Algebra Approach to Solving Chemical Equilibria in General Chemistry

    ERIC Educational Resources Information Center

    Kalainoff, Melinda; Lachance, Russ; Riegner, Dawn; Biaglow, Andrew

    2012-01-01

    In this article, we report on a semester-long study of the incorporation into our general chemistry course, of advanced algebraic and computer algebra techniques for solving chemical equilibrium problems. The method presented here is an alternative to the commonly used concentration table method for describing chemical equilibria in general…

  9. The Department of Defense Retiree Dental Program.

    DTIC Science & Technology

    1997-05-01

    treatment. An age/sex factor was also developed for orthodontics (Table 13). 76 Table 13 Retiree and Dependent Eligible Population Age Bracket Age...does not cover the more costly dental procedures such as orthodontics , endodontics, periodontics, single crowns, and fixed and removable...program under section 1076a of title 10, United States Code. Orthodontic services, crowns, gold fillings, bridges, complete or partial dentures, and

  10. 76 FR 62678 - Table Saw Blade Contact Injuries; Advance Notice of Proposed Rulemaking; Request for Comments and...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2011-10-11

    ... saw blade that is partially absorbed by the human body if contact is made. When this reduction in... tearing away of a part of the body), and crushings. Since its initial review of table saw blade contact... standards body only recently has begun to review requirements for a riving knife that may reduce certain...

  11. Progress of the equation of state table for supernova simulations and its influence

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Sumiyoshi, Kohsuke

    2012-11-12

    We describe recent progress of the EOS tables for numerical simulations of core-collapse supernovae and related astrophysical phenomena. Based on the Shen EOS table, which has been widely used in supernova simulations, there is systematic progress by extending the degrees of freedom such as hyperons and quarks. These extended EOS tables have been used, for example, to study the neutrino bursts from the gravitational collapse of massive stars leading to the black hole formation. Observations of such neutrinos from galactic events in future will provide us with the information on the EOS. Recently, studies of the supernova EOS with themore » multi-composition of nuclei under the nuclear statistical equilibrium have been made beyond the single nucleus approximation as used in the Shen EOS. It has been found that light elements including deuterons are abundant in wide regions of the supernova cores. We discuss that neutrino-deuteron reactions may have a possible influence on the explosion mechanism through modifications of neutrino heating rates.« less

  12. Table and Charts of Equilibrium Normal-shock Properties for Pure Hydrogen with Velocities to 70 km/sec. Revised.

    NASA Technical Reports Server (NTRS)

    Miller, C. G., III; Wilder, S. E.

    1976-01-01

    Errors found in the original edition are corrected. Refinement was made in procedures for solving the conservation relations for an incident (moving), standing, and reflected normal shock, as well as in computational methods for determining thermochemical-equilibrium hydrogen properties. A six-species hydrogen model replaces the original four-species model, and the heat of formation and spectroscopic constants used in this six-species model are listed in appendix A. In appendix B, comparisons are made between a number of methods for determining equilibrium thermodynamic properties for hydrogen for several values of pressure and temperatures to 50000 K. A comparison is also performed between the present method and a second method for determining thermodynamic properties and flow velocity behind an incident shock into pure hydrogen and behind a reflected shock.

  13. Finite-Rate Ablation Boundary Conditions for Carbon-Phenolic Heat-Shield

    NASA Technical Reports Server (NTRS)

    Chen, Y.-K.; Milos, Frank S.

    2003-01-01

    A formulation of finite-rate ablation surface boundary conditions, including oxidation, nitridation, and sublimation of carbonaceous material with pyrolysis gas injection, has been developed based on surface species mass conservation. These surface boundary conditions are discretized and integrated with a Navier-Stokes solver. This numerical procedure can predict aerothermal heating, chemical species concentration, and carbonaceous material ablation rate over the heatshield surface of re-entry space vehicles. In this study, the gas-gas and gas-surface interactions are established for air flow over a carbon-phenolic heatshield. Two finite-rate gas-surface interaction models are considered in the present study. The first model is based on the work of Park, and the second model includes the kinetics suggested by Zhluktov and Abe. Nineteen gas phase chemical reactions and four gas-surface interactions are considered in the present model. There is a total of fourteen gas phase chemical species, including five species for air and nine species for ablation products. Three test cases are studied in this paper. The first case is a graphite test model in the arc-jet stream; the second is a light weight Phenolic Impregnated Carbon Ablator at the Stardust re-entry peak heating conditions, and the third is a fully dense carbon-phenolic heatshield at the peak heating point of a proposed Mars Sample Return Earth Entry Vehicle. Predictions based on both finite-rate gas- surface interaction models are compared with those obtained using B' tables, which were created based on the chemical equilibrium assumption. Stagnation point convective heat fluxes predicted using Park's finite-rate model are far below those obtained from chemical equilibrium B' tables and Zhluktov's model. Recession predictions from Zhluktov's model are generally lower than those obtained from Park's model and chemical equilibrium B' tables. The effect of species mass diffusion on predicted ablation rate is also examined.

  14. SteamTables: An approach of multiple variable sets

    NASA Astrophysics Data System (ADS)

    Verma, Mahendra P.

    2009-10-01

    Using the IAPWS-95 formulation, an ActiveX component SteamTablesIIE in Visual Basic 6.0 is developed to calculate thermodynamic properties of pure water as a function of two independent intensive variables: (1) temperature ( T) or pressure ( P) and (2) T, P, volume ( V), internal energy ( U), enthalpy ( H), entropy ( S) or Gibbs free energy ( G). The second variable cannot be the same as variable 1. Additionally, it calculates the properties along the separation boundaries (i.e., sublimation, saturation, critical isochor, ice I melting, ice III to ice IIV melting and minimum volume curves) considering the input parameter as T or P for the variable 1. SteamTablesIIE is an extension of the ActiveX component SteamTables implemented earlier considering T (190 to 2000 K) and P (3.23×10 -8 to 10000 MPa) as independent variables. It takes into account the following 27 intensive properties: temperature ( T), pressure ( P), fraction, state, volume ( V), density ( Den), compressibility factor ( Z0), internal energy ( U), enthalpy ( H), Gibbs free energy ( G), Helmholtz free energy ( A), entropy ( S), heat capacity at constant pressure ( C p), heat capacity at constant volume ( C v), coefficient of thermal expansion ( CTE), isothermal compressibility ( Z iso), speed of sound ( VelS), partial derivative of P with T at constant V ( dPdT), partial derivative of T with V at constant P ( dTdV), partial derivative of V with P at constant T ( dVdP), Joule-Thomson coefficient ( JTC), isothermal throttling coefficient ( IJTC), viscosity ( Vis), thermal conductivity ( ThrmCond), surface tension ( SurfTen), Prandtl number ( PrdNum) and dielectric constant ( DielCons).

  15. Table and charts of equilibrium normal shock and shock tube properties for pure argon with velocities to 18 km/sec

    NASA Technical Reports Server (NTRS)

    Miller, C. G., III; Wilder, S. E.

    1976-01-01

    Equilibrium thermodynamic and flow properties are presented in tabulated and graphical form for moving, standing, and reflected normal shock waves in pure argon. Properties include pressure, temperature, density, enthalpy, speed of sound, entropy, molecular-weight ratio, isentropic exponent, velocity, and species mole fractions. Incident (moving) shock velocities are varied from 2 to 18 km/sec for a range of initial pressure of 5 N/sq m to 500 kN/sq m. Working charts illustrating shock tube performance with argon test gas and heated helium and hydrogen driver gases are also presented.

  16. A League Table of Teenage Births in Rich Nations. Innocenti Report Card.

    ERIC Educational Resources Information Center

    Adamson, Peter; Brown, Giorgina; Micklewright, John; Wright, Anna

    This third Innocenti Report Card presents the most up-to-date and comprehensive survey so far of teenage birth rates in the industrialized world. And it attempts at least a partial analysis of why some countries have teenage birth rates that are ten or even fifteen times higher than others. The starting point is a new league table of teenage birth…

  17. Mechanical approach to chemical transport

    PubMed Central

    Kocherginsky, Nikolai; Gruebele, Martin

    2016-01-01

    Nonequilibrium thermodynamics describes the rates of transport phenomena with the aid of various thermodynamic forces, but often the phenomenological transport coefficients are not known, and the description is not easily connected with equilibrium relations. We present a simple and intuitive model to address these issues. Our model is based on Lagrangian dynamics for chemical systems with dissipation, so one may think of the model as physicochemical mechanics. Using one main equation, the model allows a systematic derivation of all transport and equilibrium equations, subject to the limitation that heat generated or absorbed in the system must be small for the model to be valid. A table with all major examples of transport and equilibrium processes described using physicochemical mechanics is given. In equilibrium, physicochemical mechanics reduces to standard thermodynamics and the Gibbs–Duhem relation, and we show that the First and Second Laws of thermodynamics are satisfied for our system plus bath model. Out of equilibrium, our model provides relationships between transport coefficients and describes system evolution in the presence of several simultaneous external fields. The model also leads to an extension of the Onsager–Casimir reciprocal relations for properties simultaneously transported by many components. PMID:27647899

  18. Design of reinforced areas of concrete column using quadratic polynomials

    NASA Astrophysics Data System (ADS)

    Arif Gunadi, Tjiang; Parung, Herman; Rachman Djamaluddin, Abd; Arwin Amiruddin, A.

    2017-11-01

    Designing of reinforced concrete columns mostly carried out by a simple planning method which uses column interaction diagram. However, the application of this method is limited because it valids only for certain compressive strenght of the concrete and yield strength of the reinforcement. Thus, a more applicable method is still in need. Another method is the use of quadratic polynomials as a basis for the approach in designing reinforced concrete columns, where the ratio of neutral lines to the effective height of a cross section (ξ) if associated with ξ in the same cross-section with different reinforcement ratios is assumed to form a quadratic polynomial. This is identical to the basic principle used in the Simpson rule for numerical integral using quadratic polynomials and had a sufficiently accurate level of accuracy. The basis of this approach to be used both the normal force equilibrium and the moment equilibrium. The abscissa of the intersection of the two curves is the ratio that had been mentioned, since it fulfill both of the equilibrium. The application of this method is relatively more complicated than the existing method but provided with tables and graphs (N vs ξN ) and (M vs ξM ) so that its used could be simplified. The uniqueness of these tables are only distinguished based on the compresssive strength of the concrete, so in application it could be combined with various yield strenght of the reinforcement available in the market. This method could be solved by using programming languages such as Fortran.

  19. 40 CFR Table 2 to Subpart Uuu of... - Operating Limits for Metal HAP Emissions From Catalytic Cracking Units

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... daily average liquid-to-gas ratio above the limit established in the performance test. 4. Option 3: Ni.... Electrostatic precipitator Maintain the daily average Ni operating value no higher than the limit established...; maintain the monthly rolling average of the equilibrium catalyst Ni concentration no higher than the limit...

  20. 40 CFR Table 2 to Subpart Uuu of... - Operating Limits for Metal HAP Emissions From Catalytic Cracking Units

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... daily average liquid-to-gas ratio above the limit established in the performance test. 4. Option 3: Ni.... Electrostatic precipitator Maintain the daily average Ni operating value no higher than the limit established...; maintain the monthly rolling average of the equilibrium catalyst Ni concentration no higher than the limit...

  1. Expedition 11 Preflight

    NASA Image and Video Library

    2005-04-10

    European Space Agency astronaut Roberto Vittori, of Italy, left, and Expedition 11 Commander Sergei Krikalev participate in tilt table tests, Sunday, April 10, 2005, so technicians can collect pre-launch data on the state of their equilibrium prior to the April 15 launch to the International Space Station with Flight Engineer John Phillips in Baikonur, Kazakhstan. Photo Credit: (NASA/Bill Ingalls)

  2. Shock-tube thermochemistry tables for high-temperature gases. Volume 5: Carbon dioxide

    NASA Technical Reports Server (NTRS)

    Menard, W. A.; Horton, T. E.

    1971-01-01

    Equilibrium thermodynamic properties and species concentrations for carbon dioxide are tabulated for moving, standing, and reflected shock waves. Initial pressures range from 6.665 to 6665 N/sq m (0.05 to 50.0 torr), and temperatures from 2,000 to over 80,000K. In this study, 20 molecular and atomic species were considered.

  3. The determination of density and molecular weight distributions of lipoproteins by sedimentation equilibrium.

    PubMed

    Jeffrey, P D; Nichol, L W; Smith, G D

    1975-01-25

    A method is presented by which an experimental record of total concentration as a function of radial distance, obtained in a sedimentation equilibrium experiment conducted with a noninteracting mixture in the absence of a density gradient, may be analyzed to obtain the unimodal distributions of molecular weight and of partial molar volume when these vary concomitantly and continuously. Particular attention is given to the caracterization of classes of lipoproteins exhibiting Gaussian distributions of these quantities, although the analysis is applicable to other types of unimodal distribution. Equations are also formulated permitting the definition of the corresponding distributions of partial specific volume and of density. The analysis procedure is based on a method (employing Laplace transforms) developed previously, but differs from it in that it avoids the necessity of differentiating experimental results, which introduces error. The method offers certain advantages over other procedures used to characterize and compare lipoprotein samples (exhibiting unimodal distributions) with regard to the duration of the experiment, economy of the sample, and, particularly, the ability to define in principle all of the relevant distributions from one sedimentation equilibrium experiment and an external measurement of the weight average partial specific volume. These points and the steps in the analysis procedure are illustrated with experimental results obtained in the sedimentation equilibrium of a sample of human serum low density lipoprotein. The experimental parameters (such as solution density, column height, and angular velocity) used in the conduction of these experiments were selected on the basis of computer-simulated examples, which are also presented. These provide a guide for other workers interested in characterizing lipoproteins of this class.

  4. Against the grain: The physical properties of anisotropic partially molten rocks

    NASA Astrophysics Data System (ADS)

    Ghanbarzadeh, S.; Hesse, M. A.; Prodanovic, M.

    2014-12-01

    Partially molten rocks commonly develop textures that appear close to textural equilibrium, where the melt network evolves to minimize the energy of the melt-solid interfaces, while maintaining the dihedral angle θ at solid-solid-melt contact lines. Textural equilibrium provides a powerful model for the melt distribution that controls the petro-physical properties of partially molten rocks, e.g., permeability, elastic moduli, and electrical resistivity. We present the first level-set computations of three-dimensional texturally equilibrated melt networks in rocks with an anisotropic fabric. Our results show that anisotropy induces wetting of smaller grain boundary faces for θ > 0 at realistic porosities ϕ < 3%. This was previously not thought to be possible at textural equilibrium and reconciles the theory with experimental observations. Wetting of the grain boundary faces leads to a dramatic redistribution of the melt from the edges to the faces that introduces strong anisotropy in the petro-physical properties such as permeability, effective electrical conductivity and mechanical properties. Figure, on left, shows that smaller grain boundaries become wetted at relatively low melt fractions of 3% in stretched polyhedral grains with elongation factor 1.5. Right plot represents the ratio of melt electrical conductivity to effective conductivity of medium (known as formation factor) as an example of anisotropy in physical properties. The plot shows that even slight anisotropy in grains induces considerable anisotropy in electrical properties.

  5. Effect of stirring on the safety of flammable liquid mixtures.

    PubMed

    Liaw, Horng-Jang; Gerbaud, Vincent; Chen, Chan-Cheng; Shu, Chi-Min

    2010-05-15

    Flash point is the most important variable employed to characterize fire and explosion hazard of liquids. The models developed for predicting the flash point of partially miscible mixtures in the literature to date are all based on the assumption of liquid-liquid equilibrium. In real-world environments, however, the liquid-liquid equilibrium assumption does not always hold, such as the collection or accumulation of waste solvents without stirring, where complete stirring for a period of time is usually used to ensure the liquid phases being in equilibrium. This study investigated the effect of stirring on the flash-point behavior of binary partially miscible mixtures. Two series of partially miscible binary mixtures were employed to elucidate the effect of stirring. The first series was aqueous-organic mixtures, including water+1-butanol, water+2-butanol, water+isobutanol, water+1-pentanol, and water+octane; the second series was the mixtures of two flammable solvents, which included methanol+decane, methanol+2,2,4-trimethylpentane, and methanol+octane. Results reveal that for binary aqueous-organic solutions the flash-point values of unstirred mixtures were located between those of the completely stirred mixtures and those of the flammable component. Therefore, risk assessment could be done based on the flammable component flash-point value. However, for the assurance of safety, it is suggested to completely stir those mixtures before handling to reduce the risk. Copyright (c) 2010 Elsevier B.V. All rights reserved.

  6. Equilibrium radiative heating tables for aerobraking in the Martian atmosphere

    NASA Astrophysics Data System (ADS)

    Hartung, Lin C.; Sutton, Kenneth; Brauns, Frank

    1990-05-01

    Studies currently underway for Mars missions often envision the use of aerobraking for orbital capture at Mars. These missions generally involve blunt-nosed vehicles to dissipate the excess energy of the interplanetary transfer. Radiative heating may be of importance in these blunt-body flows because of the highly energetic shock layer around the blunt nose. In addition, the Martian atmosphere contains CO2, whose dissociation products are known to include strong radiators. An inviscid, equilibrium, stagnation point, radiation-coupled flow-field code has been developed for investigating blunt-body atmospheric entry. The method has been compared with ground-based and flight data for air, and reasonable agreement has been found. In the present work, the method was applied to a matrix of conditions in the Martian atmosphere. These conditions encompass most trajectories of interest for Mars exploration spacecraft. The predicted equilibrium radiative heating to the stagnation point of the vehicle is presented.

  7. Chemical reactions simulated by ground-water-quality models

    USGS Publications Warehouse

    Grove, David B.; Stollenwerk, Kenneth G.

    1987-01-01

    Recent literature concerning the modeling of chemical reactions during transport in ground water is examined with emphasis on sorption reactions. The theory of transport and reactions in porous media has been well documented. Numerous equations have been developed from this theory, to provide both continuous and sequential or multistep models, with the water phase considered for both mobile and immobile phases. Chemical reactions can be either equilibrium or non-equilibrium, and can be quantified in linear or non-linear mathematical forms. Non-equilibrium reactions can be separated into kinetic and diffusional rate-limiting mechanisms. Solutions to the equations are available by either analytical expressions or numerical techniques. Saturated and unsaturated batch, column, and field studies are discussed with one-dimensional, laboratory-column experiments predominating. A summary table is presented that references the various kinds of models studied and their applications in predicting chemical concentrations in ground waters.

  8. Equilibrium radiative heating tables for aerobraking in the Martian atmosphere

    NASA Technical Reports Server (NTRS)

    Hartung, Lin C.; Sutton, Kenneth; Brauns, Frank

    1990-01-01

    Studies currently underway for Mars missions often envision the use of aerobraking for orbital capture at Mars. These missions generally involve blunt-nosed vehicles to dissipate the excess energy of the interplanetary transfer. Radiative heating may be of importance in these blunt-body flows because of the highly energetic shock layer around the blunt nose. In addition, the Martian atmosphere contains CO2, whose dissociation products are known to include strong radiators. An inviscid, equilibrium, stagnation point, radiation-coupled flow-field code has been developed for investigating blunt-body atmospheric entry. The method has been compared with ground-based and flight data for air, and reasonable agreement has been found. In the present work, the method was applied to a matrix of conditions in the Martian atmosphere. These conditions encompass most trajectories of interest for Mars exploration spacecraft. The predicted equilibrium radiative heating to the stagnation point of the vehicle is presented.

  9. General equilibrium incidence of energy taxation

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Solow, J.L.

    1984-04-01

    The pervasiveness of energy in the economy and the numerous ways in which energy taxation can distort resource allocations implies the necessity of a general equilibrium approach to the question of energy tax incidence. The author presents a general equilibrium model that accounts for domestic energy production and energy imports, direct energy consumption and use of energy as an intermediate good, and production of energy intensive and nonenergy intensive goods. He examines the incidence of three broadly-based energy taxation policies: a tax on all energy consumption, a subsidy to domestic energy production, and a tariff on energy imports. The subsidy,more » although not a revenue raising measure, is included because, like the other policies, it acts to reduce energy imports. Such a measure may be of interest by reducing reliance on unstable foreign sources of supply. 12 references, 3 tables.« less

  10. Solar Kilns: Feasibility of Utilizing Solar Energy for Drying Lumber in Developing Countries,

    DTIC Science & Technology

    1977-01-01

    Design. .. ............. ... 52 Direct ( Greenhouse ) Design .. .. ............ ... 57 Literature Cited and Partial Bibliography of Solar Lumber Drying...experimental performance of a greenhouse -type solar kiln in Puerto Rico. (Chudnoff et al., 1966). 36"J. Table 9.--Comparison of experimental and calculated...at one dryer orientation (long axis north-south) from 30 percent to 10 percent moisture content. 49 Table 15.-- Greenhouse -type solar kiln capacity

  11. The structural phase diagram and oxygen equilibrium partial pressure of YBa 2Cu 3O 6+ x studied by neutron powder diffraction and gas volumetry

    NASA Astrophysics Data System (ADS)

    Andersen, N. H.; Lebech, B.; Poulsen, H. F.

    1990-12-01

    An experimental technique based on neutron powder diffraction and gas volumetry is presented and used to study the structural phase diagram of YBa 2Cu 3O 6+ x under equilibrium conditions in an extended part of ( x, T)-phase (0.15< x<0.92 and 25° C< T<725°C). Our experimental observations lend strong support to a recent two-dimensional anisotropic next-nearest-neighbour Ising model calculation (the ASYNNNI model) of the basal plane oxygen ordering based of first principle interaction parameters. Simultaneous measurements of the oxygen equilibrium partial pressure show anomalies, one of which proves the thermodynamic stability of the orthorhombic OII double cell structure. Striking similarity with predictions of recent model calculations support that another anomaly may be interpreted to result from local one-dimensional fluctuations in the distribution of oxygen atoms in the basal plane of tetragonal YBCO. Our pressure data also indicate that x=0.92 is a maximum obtainable oxygen concentration for oxygen pressures below 760 Torr.

  12. Solubility of oxygen in a seawater medium in equilibrium with a high-pressure oxy-helium atmosphere.

    PubMed

    Taylor, C D

    1979-06-01

    The molar oxygen concentration in a seawater medium in equilibrium with a high-pressure oxygen-helium atmosphere was measured directly in pressurized subsamples, using a modified version of the Winkler oxygen analysis. At a partial pressure of oxygen of 1 atm or less, its concentration in the aqueous phase was adequately described by Henry's Law at total pressures up to 600 atm. This phenomenon, which permits a straightforward determination of dissolved oxygen within hyperbaric systems, resulted from pressure-induced compensatory alterations in the Henry's Law variables rather than from a true obedience to the Ideal Gas Law. If the partial pressure of a gas contributes significantly to the hydrostatic pressure, Henry's Law is no longer adequate for determining its solubility within the compressed medium.

  13. Index of stations: surface-water data-collection network of Texas, September 1999

    USGS Publications Warehouse

    Gandara, Susan C.; Barbie, Dana L.

    2001-01-01

    As of September 30, 1999, the surface-water data-collection network of Texas (table 1) included 321 continuous-record streamflow stations (D), 20 continuous-record gage-height only stations (G), 24 crest-stage partial-record stations (C), 40 floodhydrograph partial-record stations (H), 25 low-flow partial-record stations (L), 1 continuous-record temperature station (M1), 25 continuous-record temperature and specific conductance stations (M2), 17 continuous-record temperature, specific conductance, dissolved oxygen, and pH stations (M4), 4 daily water-quality stations (Qd), 115 periodic water-quality stations (Qp), 17 reservoir/lake surveys for water quality stations (Qs), 85 continuous or daily reservoircontent stations (R), and 10 daily precipitation stations (Pd). Plate 1 identifies the major river basins in Texas and shows the location of the stations listed in table 1. Table 1 shows the station number and name, latitude and longitude, type of station, and office responsible for the collection of the data and maintenance of the record. An 8-digit permanent numerical designation for all gaging stations has been adopted on a nationwide basis; stations are numbered and listed in downstream order. In the downstream direction along the main stem, all stations on a tributary entering between two main-stem stations are listed between these two stations. A similar order is followed in listing stations by first rank, second rank, and other ranks of tributaries. The rank of any tributary, with respect to the stream to which it is an immediate tributary, is indicated by an indention in the table. Each indention represents one rank. This downstream order and system of indention shows which gaging stations are on tributaries between any two stations on a main stem and the rank of the tributary on which each gaging station is situated.

  14. Unitarity limits on the mass and radius of dark matter particles

    NASA Technical Reports Server (NTRS)

    Griest, Kim; Kamionkowski, Marc

    1989-01-01

    Using partial wave unitarity and the observed density of the Universe, it is show that a stable elementary particle which was once in thermal equilibrium cannot have a mass greater than 340 TeV. An extended object which was once in thermal equilibrium cannot have a radius less than 7.5 x 10(exp -7) fm. A lower limit to the relic abundance of such particles is also found.

  15. An Evolutionary Comparison of the Handicap Principle and Hybrid Equilibrium Theories of Signaling.

    PubMed

    Kane, Patrick; Zollman, Kevin J S

    2015-01-01

    The handicap principle has come under significant challenge both from empirical studies and from theoretical work. As a result, a number of alternative explanations for honest signaling have been proposed. This paper compares the evolutionary plausibility of one such alternative, the "hybrid equilibrium," to the handicap principle. We utilize computer simulations to compare these two theories as they are instantiated in Maynard Smith's Sir Philip Sidney game. We conclude that, when both types of communication are possible, evolution is unlikely to lead to handicap signaling and is far more likely to result in the partially honest signaling predicted by hybrid equilibrium theory.

  16. Linear and nonlinear stability criteria for compressible MHD flows in a gravitational field

    NASA Astrophysics Data System (ADS)

    Moawad, S. M.; Moawad

    2013-10-01

    The equilibrium and stability properties of ideal magnetohydrodynamics (MHD) of compressible flow in a gravitational field with a translational symmetry are investigated. Variational principles for the steady-state equations are formulated. The MHD equilibrium equations are obtained as critical points of a conserved Lyapunov functional. This functional consists of the sum of the total energy, the mass, the circulation along field lines (cross helicity), the momentum, and the magnetic helicity. In the unperturbed case, the equilibrium states satisfy a nonlinear second-order partial differential equation (PDE) associated with hydrodynamic Bernoulli law. The PDE can be an elliptic or a parabolic equation depending on increasing the poloidal flow speed. Linear and nonlinear Lyapunov stability conditions under translational symmetric perturbations are established for the equilibrium states.

  17. Partial Reform Equilibrium in Russia: A Case Study of the Political Interests of and in the Russian Gas and Oil Industry

    NASA Astrophysics Data System (ADS)

    Everett, Rabekah

    While several theories abound that attempt to explain the obstacles to democracy in Russia, Joel Hellman's partial reform equilibrium model is an institutional theory that illustrates how weak institutions, combined with an instrumentalist cultural approach to the law and authoritarian-minded leadership, allowed the struggle over interests to craft and determine the nature of Russia's political structure. This thesis builds on the work of Hellman by using the partial reform theory to understand the evolution of interest infiltration and their impact on the formation of policies and institutions in favour of the elites or winners from 2004 to the present time period that allow them to wield law as a political weapon. The hypothesis posits that through their vested interests in state politics, the political and economic elites of the oil and gas industry have successfully stalled reform in Russia resulting in partial reform equilibrium. This is illustrated in a case study that was designed to collect the names, backgrounds, and social networks of gas and oil executives in order to determine how many of them have a history of, or are currently working as, ministers in the government or representatives in the Federation Council. The objective being to measure the degree to which gas and oil interests are present in government decision-making and conversely, the degree to which the government is present in the gas and oil industry. The thesis stresses the importance of institutional structure in determining Russia's political evolution, and uses vested interests as a primary source of structural institutional change, while also stressing on the social and international implications of this evolution.

  18. Magnetar giant flares in multipolar magnetic fields. I. Fully and partially open eruptions of flux ropes

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Huang, Lei; Yu, Cong, E-mail: muduri@shao.ac.cn, E-mail: cyu@ynao.ac.cn

    2014-04-01

    We propose a catastrophic eruption model for the enormous energy release of magnetars during giant flares, in which a toroidal and helically twisted flux rope is embedded within a force-free magnetosphere. The flux rope stays in stable equilibrium states initially and evolves quasi-statically. Upon the loss of equilibrium, the flux rope cannot sustain the stable equilibrium states and erupts catastrophically. During the process, the magnetic energy stored in the magnetosphere is rapidly released as the result of destabilization of global magnetic topology. The magnetospheric energy that could be accumulated is of vital importance for the outbursts of magnetars. We carefullymore » establish the fully open fields and partially open fields for various boundary conditions at the magnetar surface and study the relevant energy thresholds. By investigating the magnetic energy accumulated at the critical catastrophic point, we find that it is possible to drive fully open eruptions for dipole-dominated background fields. Nevertheless, it is hard to generate fully open magnetic eruptions for multipolar background fields. Given the observational importance of the multipolar magnetic fields in the vicinity of the magnetar surface, it would be worthwhile to explore the possibility of the alternative eruption approach in multipolar background fields. Fortunately, we find that flux ropes may give rise to partially open eruptions in the multipolar fields, which involve only partial opening of background fields. The energy release fractions are greater for cases with central-arcaded multipoles than those with central-caved multipoles that emerged in background fields. Eruptions would fail only when the centrally caved multipoles become extremely strong.« less

  19. On FAST3D simulations of directly-driven inertial-fusion targets with high-Z layers for reducing laser imprint and surface non-uniformity growth

    NASA Astrophysics Data System (ADS)

    Bates, Jason; Schmitt, Andrew; Klapisch, Marcel; Karasik, Max; Obenschain, Steve

    2013-10-01

    Modifications to the FAST3D code have been made to enhance its ability to simulate the dynamics of plastic ICF targets with high-Z overcoats. This class of problems is challenging computationally due in part to plasma conditions that are not in a state of local thermodynamic equilibrium and to the presence of mixed computational cells containing more than one material. Recently, new opacity tables for gold, palladium and plastic have been generated with an improved version of the STA code. These improved tables provide smoother, higher-fidelity opacity data over a wider range of temperature and density states than before, and contribute to a more accurate treatment of radiative transfer processes in FAST3D simulations. Furthermore, a new, more efficient subroutine known as ``MMEOS'' has been installed in the FAST3D code for determining pressure and temperature equilibrium conditions within cells containing multiple materials. We will discuss these topics, and present new simulation results for high-Z planar-target experiments performed recently on the NIKE Laser Facility. Work supported by DOE/NNSA.

  20. 40 CFR Table 2 to Subpart Ggg of... - Partially Soluble HAP

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    ... Trichloroethylene Chloroethane (ethyl chloride) Trimethylpentane Vinyl acetate Xylene (p) Vinyl chloride N-hexane... Methylene chloride Allyl chloride N,N-dimethylaniline Benzene Propionaldehyde Benzyl chloride Propylene...

  1. 40 CFR Table 2 to Subpart Ggg of... - Partially Soluble HAP

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... Trichloroethylene Chloroethane (ethyl chloride) Trimethylpentane Vinyl acetate Xylene (p) Vinyl chloride N-hexane... Methylene chloride Allyl chloride N,N-dimethylaniline Benzene Propionaldehyde Benzyl chloride Propylene...

  2. 40 CFR Table 2 to Subpart Ggg of... - Partially Soluble HAP

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... Trichloroethylene Chloroethane (ethyl chloride) Trimethylpentane Vinyl acetate Xylene (p) Vinyl chloride N-hexane... Methylene chloride Allyl chloride N,N-dimethylaniline Benzene Propionaldehyde Benzyl chloride Propylene...

  3. On statistical independence of a contingency matrix

    NASA Astrophysics Data System (ADS)

    Tsumoto, Shusaku; Hirano, Shoji

    2005-03-01

    A contingency table summarizes the conditional frequencies of two attributes and shows how these two attributes are dependent on each other with the information on a partition of universe generated by these attributes. Thus, this table can be viewed as a relation between two attributes with respect to information granularity. This paper focuses on several characteristics of linear and statistical independence in a contingency table from the viewpoint of granular computing, which shows that statistical independence in a contingency table is a special form of linear dependence. The discussions also show that when a contingency table is viewed as a matrix, called a contingency matrix, its rank is equal to 1.0. Thus, the degree of independence, rank plays a very important role in extracting a probabilistic model from a given contingency table. Furthermore, it is found that in some cases, partial rows or columns will satisfy the condition of statistical independence, which can be viewed as a solving process of Diophatine equations.

  4. Field data and numerical simulation of btex concentration trends under water table fluctuations: Example of a jet fuel-contaminated site in Brazil

    NASA Astrophysics Data System (ADS)

    Teramoto, Elias Hideo; Chang, Hung Kiang

    2017-03-01

    Mass transfer of light non-aqueous phase liquids (LNAPLs) trapped in porous media is a complex phenomenon. Water table fluctuations have been identified as responsible for generating significant variations in the concentration of dissolved hydrocarbons. Based on field evidence, this work presents a conceptual model and a numerical solution for mass transfer from entrapped LNAPL to groundwater controlled by both LNAPL saturation and seasonal water table fluctuations within the LNAPL smear zone. The numerical approach is capable of reproducing aqueous BTEX concentration trends under three different scenarios - water table fluctuating within smear zone, above the smear zone and partially within smear zone, resulting in in-phase, out-of-phase and alternating in-phase and out-of-phase BTEX concentration trend with respect to water table oscillation, respectively. The results demonstrate the model's applicability under observed field conditions and its ability to predict source zone depletion.

  5. Corrigendum to "The partial molal volume and compressibility of Tris and Tris-HCl in water and 0.725 m NaCl as a function of temperature," [Deep-Sea Res. I 104 (2015) 41-51

    NASA Astrophysics Data System (ADS)

    Rodriguez, Carmen; Huang, Fen; Millero, Frank J.

    2016-08-01

    The authors of Rodriguez et al. (2015) regret some incorrect values published in Tables 8 and 9. The values shown in Table 8 for V bar 0 and κ bar 0 of Tris-HCl in 0.725 m NaCl, and the values shown in Table 9 for ΔV and Δκ in 0.725 m NaCl were from an earlier calculation that was later revised. The correct values are provided below. Importantly, all other values printed in the manuscript are correct (e.g., coefficients in Tables 5-7, Table 8, Eqs. (22)-(25)). The discussions and conclusions made in this paper are not affected by these changes. The authors would like to acknowledge Yui Takeshita of Stanford University for bringing this to our attention. We apologize for any inconvenience caused.

  6. A Cost Prediction Model for Electronic Systems Flight Test Costs.

    DTIC Science & Technology

    1983-09-01

    development. It was found that a significant cost estimating relationship (CER) exists between costs and the characteristics of the flight test design. Using...University In Partial Fulfillment of the Requirements for the Degree of Master of Science in Systems Management By C ., Thomas 3. DuPre’, BS Accession...SYSTEMS MANAGEMENT DATE: 28 September 1983 COMMITTEE CHA. ICEAfER it TABLE OF CONTENTS Page LIST OF TABLES ......................... vi LIST OF FIGURES

  7. Temporal changes in the configuration of the water table in the vicinity of the management systems evaluation area site, central Nebraska

    USGS Publications Warehouse

    Kilpatrick, John M.

    1996-01-01

    To improve understanding of the hydrologic characteristics of the shallow aquifer in the vicinity of the Management Systems Evaluation Area site near Shelton, Nebraska, water levels were measured in approximately 130 observation wells in both June and September 1991. Two water-table maps and a water-level-change map were drawn on the basis of these measurements. In addition, historical data from U.S. Geological Survey computer files and published reports were used to determine the approximate configuration of the water table in 1931 and to draw one short-term and two-long term water- level hydrographs. Comparison of the three water- table maps indicates general similarities. The average horizontal hydraulic gradient in the shallow aquifer is about 7.5 feet per mile, and the flow direction is to the east-northeast. The water table declined 2 to 10 feet between June and September 1991, with the greatest decline occurring in a wedge-shaped area south of the Wood River and north of the Platte River. The 1991 water-table configurations appear to indicate that the aquifer either was discharging to the Platte River in this reach or there was little flow between the river and the aquifer. Comparison of the 1931 and 1991 water-table maps indicates that, except for short-term variations, the water-table configuration changed little during this 61-year period. Two long-term water-level hydrographs confirm this conclusion, indicating that the shallow aquifer in this area has been in long-term, dynamic equilibrium.

  8. Nonflat equilibrium liquid shapes on flat surfaces.

    PubMed

    Starov, Victor M

    2004-01-15

    The hydrostatic pressure in thin liquid layers differs from the pressure in the ambient air. This difference is caused by the actions of surface forces and capillary pressure. The manifestation of the surface force action is the disjoining pressure, which has a very special S-shaped form in the case of partial wetting (aqueous thin films and thin films of aqueous electrolyte and surfactant solutions, both free films and films on solid substrates). In thin flat liquid films the disjoining pressure acts alone and determines their thickness. However, if the film surface is curved then both the disjoining and the capillary pressures act simultaneously. In the case of partial wetting their simultaneous action results in the existence of nonflat equilibrium liquid shapes. It is shown that in the case of S-shaped disjoining pressure isotherm microdrops, microdepressions, and equilibrium periodic films exist on flat solid substrates. Criteria are found for both the existence and the stability of these nonflat equilibrium liquid shapes. It is shown that a transition from thick films to thinner films can go via intermediate nonflat states, microdepressions and periodic films, which both can be more stable than flat films within some range of hydrostatic pressure. Experimental investigations of shapes of the predicted nonflat layers can open new possibilities of determination of disjoining pressure in the range of thickness in which flat films are unstable.

  9. Partial root-zone drying and conventional deficit irrigation applied during the whole berry growth maintain yield and berry quality in 'Crimson Seedless' table grapes

    NASA Astrophysics Data System (ADS)

    Pérez-Pastor, Alejandro; Domingo, Rafael; De la Rosa, Jose M.°; Rosario Conesa Saura, M.°

    2016-04-01

    To compare the effects of partial root-zone drying and conventional deficit irrigation applied during post-veraison and the whole berry growth on water relations, yield and berry quality, one experiment was conducted in a commercial vineyard of 'Crimson Seedless' table grapes. Five irrigation treatments were imposed: (i) Control (CTL) irrigated to 110% of crop evapotranspiration (ETc), (ii) regulated deficit irrigation (RDI) irrigated at 50% of CTL during the non- critical period of post-verasion, (iii) continuous deficit irrigation (DIc), irrigated at 50% of CTL throughout the whole berry growing season, (iv) partial root-zone drying (PRD), irrigated similar to RDI, but alternating the irrigation applied in the dry side every 10-14 days; and (v) continuous partial root-zone drying (PRDc), irrigated as DIc but alternating the irrigation in the dry side every 10-14 days. RDI and PRD received 24% and 28% less water than CTL, respectively. These reductions were higher in DIc and PRDc (65% and 53%, respectively). Total yield was not affected by any DI strategy. Only significantly lower values were observed in the weight and height's berries in respect to CTL. However, the colour parameters evaluated increased in all DI treatments, being slightly higher in DIc and PRDc compared with RDI and PRD. In addition, total soluble solids (TSS) were significantly higher in DIc, compared to other irrigated counterparts. Our findings showed that the application of water deficit during the whole berry growth through the use of DIc and PRDc, can be considered for irrigation scheduling in 'Crimson Seedless' table grapes. Acknowledgements This work has been funded by the European Union LIFE+ project IRRIMAN (LIFE13 ENV/ES/000539).

  10. Polymer Coatings Degradation Properties

    DTIC Science & Technology

    1985-02-01

    undertaken 124). The Box-Jenkins approach first evaluates the partial auto -correlation function and determines the order of the moving average memory function...78 - Tables 15 and 16 show the resalit- f- a, the partial auto correlation plots. Second order moving .-. "ra ;;th -he appropriate lags were...coated films. Kaempf, Guenter; Papenroth, Wolfgang; Kunststoffe Date: 1982 Volume: 72 Number:7 Pages: 424-429 Parameters influencing the accelerated

  11. The annealing mechanism of the radiation-induced vacancy-oxygen defect in silicon

    NASA Astrophysics Data System (ADS)

    Voronkov, V. V.; Falster, R.; Londos, C. A.

    2012-06-01

    Annealing experiments on the VO defect (the A-centre) produced by radiation in silicon—reported long ago—have been re-examined in order to deduce the two most important properties of VO: its diffusivity and the equilibrium constant for VO dissociation into V + O. The loss rate of VO is accounted for by two major reactions. One is the conventional reaction of the trapping of mobile VO by oxygen, thus producing VO2. The other is an annihilation of vacancies, which coexist in an equilibrium ratio with VO, by radiation-produced interstitial point defects. In some cases, a minor reaction, VO + V, should also be taken into account. The emerging minor defects V2O are also highly mobile. They partially dissociate back and partially get trapped by oxygen producing stable V2O2 defects.

  12. Implementation of Radiation, Ablation, and Free Energy Minimization Modules for Coupled Simulations of Hypersonic Flow

    NASA Technical Reports Server (NTRS)

    Gnoffo, Peter A.; Johnston, Christopher O.; Thompson, Richard A.

    2009-01-01

    A description of models and boundary conditions required for coupling radiation and ablation physics to a hypersonic flow simulation is provided. Chemical equilibrium routines for varying elemental mass fraction are required in the flow solver to integrate with the equilibrium chemistry assumption employed in the ablation models. The capability also enables an equilibrium catalytic wall boundary condition in the non-ablating case. The paper focuses on numerical implementation issues using FIRE II, Mars return, and Apollo 4 applications to provide context for discussion. Variable relaxation factors applied to the Jacobian elements of partial equilibrium relations required for convergence are defined. Challenges of strong radiation coupling in a shock capturing algorithm are addressed. Results are presented to show how the current suite of models responds to a wide variety of conditions involving coupled radiation and ablation.

  13. 40 CFR Table 7 to Subpart Vvvvvv... - Partially Soluble HAP

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 111444 31. Dinitrophenol 51285 32. Epichlorohydrin 106898 33. Ethyl acrylate 140885 34. Ethylbenzene.... Hexachlorobutadiene 87683 39. Hexachloroethane 67721 40. Methyl methacrylate 80626 41. Methyl-t-butyl ether 1634044 42...

  14. 40 CFR Table 7 to Subpart Vvvvvv... - Partially Soluble HAP

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 111444 31. Dinitrophenol 51285 32. Epichlorohydrin 106898 33. Ethyl acrylate 140885 34. Ethylbenzene.... Hexachlorobutadiene 87683 39. Hexachloroethane 67721 40. Methyl methacrylate 80626 41. Methyl-t-butyl ether 1634044 42...

  15. 40 CFR Table 2 to Subpart Ggg of... - Partially Soluble HAP

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    ... Xylene (p) Vinyl chloride N-hexane Xylene (m) Xylene (o) [66 FR 40136, Aug. 2, 2001] ... Acrylonitrile Methylene chloride Allyl chloride N,N-dimethylaniline Benzene Propionaldehyde Benzyl chloride...

  16. 40 CFR Table 2 to Subpart Ggg of... - Partially Soluble HAP

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    ... Xylene (p) Vinyl chloride N-hexane Xylene (m) Xylene (o) [66 FR 40136, Aug. 2, 2001] ... Acrylonitrile Methylene chloride Allyl chloride N,N-dimethylaniline Benzene Propionaldehyde Benzyl chloride...

  17. The thermodynamic properties of oxygen and nitrogen

    NASA Technical Reports Server (NTRS)

    Stewart, R. B.; Jacobsen, R. T.; Myers, A. F.

    1972-01-01

    The development of a single equation of state for oxygen and nitrogen based on the thermodynamic properties of the gases is described. The coefficients of the equation of state were determined by simultaneous least squares fits to values of isochoric heat capacity and saturation density values used to define the criteria for phase equilibrium. Tables of data for the conditions of both gases are included.

  18. Improvements to a global-scale groundwater model to estimate the water table across New Zealand

    NASA Astrophysics Data System (ADS)

    Westerhoff, Rogier; Miguez-Macho, Gonzalo; White, Paul

    2017-04-01

    Groundwater models at the global scale have become increasingly important in recent years to assess the effects of climate change and groundwater depletion. However, these global-scale models are typically not used for studies at the catchment scale, because they are simplified and too spatially coarse. In this study, we improved the global-scale Equilibrium Water Table (EWT) model, so it could better assess water table depth and water table elevation at the national scale for New Zealand. The resulting National Water Table (NWT) model used improved input data (i.e., national input data of terrain, geology, and recharge) and model equations (e.g., a hydraulic conductivity - depth relation). The NWT model produced maps of the water table that identified the main alluvial aquifers with fine spatial detail. Two regional case studies at the catchment scale demonstrated excellent correlation between the water table elevation and observations of hydraulic head. The NWT water tables are an improved water table estimation over the EWT model. In two case studies the NWT model provided a better approximation to observed water table for deep aquifers and the improved resolution of the model provided the capability to fill the gaps in data-sparse areas. This national model calculated water table depth and elevation across regional jurisdictions. Therefore, the model is relevant where trans-boundary issues, such as source protection and catchment boundary definition, occur. The NWT model also has the potential to constrain the uncertainty of catchment-scale models, particularly where data are sparse. Shortcomings of the NWT model are caused by the inaccuracy of input data and the simplified model properties. Future research should focus on improved estimation of input data (e.g., hydraulic conductivity and terrain). However, more advanced catchment-scale groundwater models should be used where groundwater flow is dominated by confining layers and fractures.

  19. First-principles investigations of equilibrium Ca, Mg, Si and O isotope fractionations between silicate melts and minerals

    NASA Astrophysics Data System (ADS)

    Qi, Y.; Liu, X.; Kang, J.; He, L.

    2017-12-01

    Equilibrium isotope fractionation factors are essential for using stable isotope data to study many geosciences processes such as planetary differentiation and mantle evolution. The mass-dependent equilibrium isotope fractionation is primarily controlled by the difference in bond energies triggered by the isotope substitution. With the recent advances in computational capabilities, first-principles calculation has become a reliable tool to investigate equilibrium isotopic fractionations, greatly improving our understanding of the factors controlling isotope fractionations. It is important to understand the isotope fractionation between melts and minerals because magmatism is critical for creating and shaping the Earth. However, because isotope fractionation between melts and minerals is small at high temperature, it is difficult to experimentally calibrate such small signature. Due to the disordered and dynamic character of melts, calculations of equilibrium isotope fractionation of melts are more challenging than that for gaseous molecules or minerals. Here, we apply first-principles molecular dynamics method to calculate equilibrium Ca, Mg, Si, and O isotope fractionations between silicate melts and minerals. Our results show that equilibrium Mg, Si, and O isotope fractionations between olivine and pure Mg2SiO4 melt are close to zero at high temperature (e.g. δ26Mgmelt-ol = 0.03 ± 0.04‰, δ30Simelt-ol = -0.06 ± 0.07‰, δ18Omelt-ol = 0.07‰ ± 0.08 at 1500 K). Equilibrium Ca, Mg, Si, and O isotope fractionations between diopside and basalt melt (67% CaMgSi2O6 + 33% CaAl2Si2O8) are also negligible at high temperature (e.g. δ44/40Camelt-cpx = -0.01 ± 0.02‰, δ26Mgmelt-cpx = -0.05 ± 0.14‰, δ30Simelt-cpx = 0.04 ± 0.04‰, δ18Omelt-cpx = 0.03 ± 0.07‰ at 1500 K). These results are consistent with the observations in natural samples that there is no significant Ca, Mg, Si, and O isotope fractionation during mantle partial melting, demonstrating the reliability of our methods. Thus, our results can be used to understand stable isotope fractionation during partial melting of mantle peridotite or fractional crystallization during magmatic differentiation. The first-principles molecular dynamics method is a promising tool to obtain equilibrium fractionation of more isotope systems for complicate liquids.

  20. An Evolutionary Comparison of the Handicap Principle and Hybrid Equilibrium Theories of Signaling

    PubMed Central

    Kane, Patrick; Zollman, Kevin J. S.

    2015-01-01

    The handicap principle has come under significant challenge both from empirical studies and from theoretical work. As a result, a number of alternative explanations for honest signaling have been proposed. This paper compares the evolutionary plausibility of one such alternative, the “hybrid equilibrium,” to the handicap principle. We utilize computer simulations to compare these two theories as they are instantiated in Maynard Smith’s Sir Philip Sidney game. We conclude that, when both types of communication are possible, evolution is unlikely to lead to handicap signaling and is far more likely to result in the partially honest signaling predicted by hybrid equilibrium theory. PMID:26348617

  1. Computational methods for reactive transport modeling: A Gibbs energy minimization approach for multiphase equilibrium calculations

    NASA Astrophysics Data System (ADS)

    Leal, Allan M. M.; Kulik, Dmitrii A.; Kosakowski, Georg

    2016-02-01

    We present a numerical method for multiphase chemical equilibrium calculations based on a Gibbs energy minimization approach. The method can accurately and efficiently determine the stable phase assemblage at equilibrium independently of the type of phases and species that constitute the chemical system. We have successfully applied our chemical equilibrium algorithm in reactive transport simulations to demonstrate its effective use in computationally intensive applications. We used FEniCS to solve the governing partial differential equations of mass transport in porous media using finite element methods in unstructured meshes. Our equilibrium calculations were benchmarked with GEMS3K, the numerical kernel of the geochemical package GEMS. This allowed us to compare our results with a well-established Gibbs energy minimization algorithm, as well as their performance on every mesh node, at every time step of the transport simulation. The benchmark shows that our novel chemical equilibrium algorithm is accurate, robust, and efficient for reactive transport applications, and it is an improvement over the Gibbs energy minimization algorithm used in GEMS3K. The proposed chemical equilibrium method has been implemented in Reaktoro, a unified framework for modeling chemically reactive systems, which is now used as an alternative numerical kernel of GEMS.

  2. 40 CFR 61.341 - Definitions.

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... to industrial organic chemicals, organic pesticide products, pharmaceutical preparations, paint and allied products, fertilizers, and agricultural chemicals. Examples of chemical manufacturing plants...). Maximum organic vapor pressure means the equilibrium partial pressure exerted by the waste at the...

  3. Morphology of single Shockley-type stacking faults generated by recombination enhanced dislocation glide in 4H-SiC

    NASA Astrophysics Data System (ADS)

    Matsuhata, Hirofumi; Sekiguchi, Takashi

    2018-04-01

    Morphology of single Shockley-type stacking faults (SFs) generated by recombination enhanced dislocation glide (REDG) in 4H-SiC are discussed and analysed. A complete set of the 12 different dissociated states of basal-plane dislocation loops is obtained using the crystallographic space group operations. From this set, six different double rhombic-shaped SFs are derived. These tables indicate the rules that connect shapes of SFs with the locations of partial dislocations having different core structures, the positions of slip planes in a unit cell, and the Burgers vectors of partial dislocations. We applied these tables for the analysis of SFs generated by the REDG effect reported in the past articles. Shapes, growing process of SFs and perfect dislocations for origins of SFs were well analysed systematically.

  4. Phase Equilibria of ``Cu2O''-``FeO''-CaO-MgO-Al2O3 Slags at PO2 of 10-8.5 atm in Equilibrium with Metallic Copper for a Copper Slag Cleaning Production

    NASA Astrophysics Data System (ADS)

    Henao, Hector M.; Pizarro, Claudio; Font, Jonkion; Moyano, Alex; Hayes, Peter C.; Jak, Evgueni

    2010-12-01

    Limited data are available on phase equilibria of the multicomponent slag system at the oxygen partial pressures used in the copper smelting, converting, and slag-cleaning processes. Recently, experimental procedures have been developed and have been applied successfully to characterize several complex industrial slags. The experimental procedures involve high-temperature equilibration on a substrate and quenching followed by electron probe X-ray microanalysis. This technique has been used to construct the liquidus for the “Cu2O”-“FeO”-SiO2-based slags with 2 wt pct of CaO, 0.5 wt pct of MgO, and 4.0 wt pct of Al2O3 at controlled oxygen partial pressures in equilibrium with metallic copper. The selected ranges of compositions and temperatures are directly relevant to the copper slag-cleaning processes. The new experimental equilibrium results are presented in the form of ternary sections and as a liquidus temperature vs Fe/SiO2 weight ratio diagram. The experimental results are compared with the FactSage thermodynamic model calculations.

  5. Numerical solution of Space Shuttle Orbiter flow field including real gas effects

    NASA Technical Reports Server (NTRS)

    Prabhu, D. K.; Tannehill, J. C.

    1984-01-01

    The hypersonic, laminar flow around the Space Shuttle Orbiter has been computed for both an ideal gas (gamma = 1.2) and equilibrium air using a real-gas, parabolized Navier-Stokes code. This code employs a generalized coordinate transformation; hence, it places no restrictions on the orientation of the solution surfaces. The initial solution in the nose region was computed using a 3-D, real-gas, time-dependent Navier-Stokes code. The thermodynamic and transport properties of equilibrium air were obtained from either approximate curve fits or a table look-up procedure. Numerical results are presented for flight conditions corresponding to the STS-3 trajectory. The computed surface pressures and convective heating rates are compared with data from the STS-3 flight.

  6. An Investigation of Applications for Thermodynamic Work Potential Methods: Working Tables and Charts for Estimation of Thermodynamic Work Potential in Equilibrium Mixtures of Jet-A and Air

    NASA Technical Reports Server (NTRS)

    Mavris, Dimitri; Roth, Bryce; McDonald, Rob

    2002-01-01

    The objective of this report is to provide a tool to facilitate the application of thermodynamic work potential methods to aircraft and engine analysis. This starts with a discussion of the theoretical background underlying these methods, which is then used to derive various equations useful for thermodynamic analysis of aircraft engines. The work potential analysis method is implemented in the form of a set of working charts and tables that can be used to graphically evaluate work potential stored in high-enthalpy gas. The range of validity for these tables is 300 to 36,000 R, pressures between between 0.01 atm and 100 atm, and fuel-air ratios from zero to stoichiometric. The derivations and charts assume mixtures of Jet-A and air as the working fluid. The thermodynamic properties presented in these charts were calculated based upon standard thermodynamic curve fits.

  7. Equilibrium Partitioning Sediment Guidelines (ESGs) for the ...

    EPA Pesticide Factsheets

    ... PLC = partial life-cycle ... 5 ii mini iiiiiiiii iiiiiii mi 1 1 iii mini ii i B : - Benthic vs WQC i— w ~_ ~ _ o° _ -0 ° - - - ii mini iiiiiiiii iiiiiii iiiiiiiii mini ii 0.1 ... PhD thesis. ...

  8. The Diversity ECCM Performance of Frequency-Hopping CPFSK in Partial- Band Noise Jamming

    DTIC Science & Technology

    1988-05-25

    TELEPHONE (Inc€ude Art Code) 22c. OFFICE SYMBOL 1 ar .anoer (919) 549-0641 ARO: EL-S D FORM 1473.6 4 MAR 83 APR edition may be used until exhausted...ASSOCIATES, INC. TABLE OF CONTENTS Page 1.0 INTRODUCTION ...... .... ......................... 1 1.1 BACKGROUND ...... ......................... I 1.2...andJ/or Dit Special t -. V 1 atI J. S. LEE ASSOCIATES, INC. -S TABLE OF CONTENTS (Cont.) . - Page 2.2 ERROR PROBA3ILITY FORMULATION .5

  9. Broadband Photometry of the Potentially Hazardous Asteroid 2013 RH74

    NASA Astrophysics Data System (ADS)

    Hicks, M.; Ebelhar, S.

    2013-11-01

    The Near-Earth Asteroid (NEA) 2013 RH74 was discovered by the Catalina Sky Survey on September 15 2013 (MPEC 2013-S15) and has been designated as a Potentially Hazardous Asteroid (PHA) by the Minor Planet Center. We obtained six partial nights of broadband Bessel BVRI photometry at the JPL Table Mountain 0.6-m telescope (TMO), as summarized in Table 1. This object was detected by planetary radar soon after discovery (http://echo.jpl.nasa.gov/asteroids/index.html).

  10. Bulk viscosity of the Lennard-Jones fluid for a wide range of states computed by equilibrium molecular dynamics

    NASA Astrophysics Data System (ADS)

    Hoheisel, C.; Vogelsang, R.; Schoen, M.

    1987-12-01

    Accurate data for the bulk viscosity ηv have been obtained by molecular dynamics calculations. Many thermodynamic states of the Lennard-Jones fluid were considered. The Green-Kubo integrand of ηv is analyzed in terms of partial correlation functions constituting the total one. These partial functions behave rather differently from those found for the shear viscosity or the thermal conductivity. Generally the total autocorrelation function of ηv shows a steeper initial decay and a more pronounced long time form than those of the shear viscosity or the thermal conductivity. For states near transition to solid phases, like the pseudotriple point of argon, the Green-Kubo integrand of ηv has a significantly longer ranged time behavior than that of the shear viscosity. Hence, for the latter states, a systematic error is expected for ηv using equilibrium molecular dynamics for its computation.

  11. Local equilibrium of mafic enclaves and granitoids of the Turtle pluton, southeast California: Mineral, chemical, and isotopic evidence

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Allen, C.M.

    Major element and trace element compositions of whole rocks, mineral compositions, and Rb-Sr isotopic compositions of enclave and host granitoid pairs from the Early Cretaceous, calc-alkaline Turtle pluton of southeastern California suggest that the local environmental profoundly affects some enclave types. In the Turtle pluton, where the source of fine-grained, mafic enclaves can be deduced to be magmatic by the presence of partially disaggregated basaltic dikes, mineral chemistry suggests partial or complete local equilibrium among mineral species in the enclave and its host granitoid. Because of local Rb-Sr isotopic equilibration between fine-grained enclaves and host granitoid, one cannot use Srmore » isotopes to distinguish an enclave source independent of its host rocks from an enclave source related to the enclosing pluton. However, preliminary Nd isotopic data suggest an independent, mantle source for enclaves.« less

  12. Plasma Equilibrium in a Magnetic Field with Stochastic Field-Line Trajectories

    NASA Astrophysics Data System (ADS)

    Krommes, J. A.; Reiman, A. H.

    2008-11-01

    The nature of plasma equilibrium in a magnetic field with stochastic field lines is examined, expanding upon the ideas first described by Reiman et al. The magnetic partial differential equation (PDE) that determines the equilibrium Pfirsch-Schlüter currents is treated as a passive stochastic PDE for μj/B. Renormalization leads to a stochastic Langevin equation for μ in which the resonances at the rational surfaces are broadened by the stochastic diffusion of the field lines; even weak radial diffusion can significantly affect the equilibrium, which need not be flattened in the stochastic region. Particular attention is paid to satisfying the periodicity constraints in toroidal configurations with sheared magnetic fields. A numerical scheme that couples the renormalized Langevin equation to Ampere's law is described. A. Reiman et al, Nucl. Fusion 47, 572--8 (2007). J. A. Krommes, Phys. Reports 360, 1--351.

  13. Spreading of a pendant liquid drop underneath a textured substrate

    NASA Astrophysics Data System (ADS)

    Mistry, Aashutosh; Muralidhar, K.

    2018-04-01

    A pendant drop spreading underneath a partially wetting surface from an initial shape to its final equilibrium configuration and contact angle is studied. A mathematical formulation that quantifies spreading behavior of liquid drops over textured surfaces is discussed. The drop volume and the equilibrium contact angle are treated as parameters in the study. The unbalanced force at the three-phase contact line is modeled as being proportional to the degree of departure from the equilibrium state. Model predictions are verified against the available experimental data in the literature. Results show that the flow dynamics is strongly influenced by the fluid properties, drop volume, and contact angle of the liquid with the partially wetting surface. The drop exhibits rich dynamical behavior including inertial oscillations and gravitational instability, given that gravity tries to detach the drop against wetting contributions. Flow characteristics of drop motion, namely, the radius of the footprint, slip length, and dynamic contact angle in the pendant configuration are presented. Given the interplay among the competing time-dependent forces, a spreading drop can momentarily be destabilized and not achieve a stable equilibrium shape. Instability is then controlled by the initial drop shape as well. The spreading model is used to delineate stable and unstable regimes in the parameter space. Predictions of the drop volume based on the Young-Laplace equation are seen to be conservative relative to the estimates of the dynamical model discussed in the present study.

  14. Field data and numerical simulation of btex concentration trends under water table fluctuations: Example of a jet fuel-contaminated site in Brazil.

    PubMed

    Teramoto, Elias Hideo; Chang, Hung Kiang

    2017-03-01

    Mass transfer of light non-aqueous phase liquids (LNAPLs) trapped in porous media is a complex phenomenon. Water table fluctuations have been identified as responsible for generating significant variations in the concentration of dissolved hydrocarbons. Based on field evidence, this work presents a conceptual model and a numerical solution for mass transfer from entrapped LNAPL to groundwater controlled by both LNAPL saturation and seasonal water table fluctuations within the LNAPL smear zone. The numerical approach is capable of reproducing aqueous BTEX concentration trends under three different scenarios - water table fluctuating within smear zone, above the smear zone and partially within smear zone, resulting in in-phase, out-of-phase and alternating in-phase and out-of-phase BTEX concentration trend with respect to water table oscillation, respectively. The results demonstrate the model's applicability under observed field conditions and its ability to predict source zone depletion. Copyright © 2017 Elsevier B.V. All rights reserved.

  15. Wavelength assignment algorithm considering the state of neighborhood links for OBS networks

    NASA Astrophysics Data System (ADS)

    Tanaka, Yu; Hirota, Yusuke; Tode, Hideki; Murakami, Koso

    2005-10-01

    Recently, Optical WDM technology is introduced into backbone networks. On the other hand, as the future optical switching scheme, Optical Burst Switching (OBS) systems become a realistic solution. OBS systems do not consider buffering in intermediate nodes. Thus, it is an important issue to avoid overlapping wavelength reservation between partially interfered paths. To solve this problem, so far, the wavelength assignment scheme which has priority management tables has been proposed. This method achieves the reduction of burst blocking probability. However, this priority management table requires huge memory space. In this paper, we propose a wavelength assignment algorithm that reduces both the number of priority management tables and burst blocking probability. To reduce priority management tables, we allocate and manage them for each link. To reduce burst blocking probability, our method announces information about the change of their priorities to intermediate nodes. We evaluate its performance in terms of the burst blocking probability and the reduction rate of priority management tables.

  16. Northern part, Ten Mile and Taunton River basins

    USGS Publications Warehouse

    Williams, John R.; Willey, Richard E.

    1967-01-01

    This report is one of two prepared by the Geological Survey for the Water Resources Commission. The principal purpose of this report is to make available the basic data on which the other, a map showing availability of ground water, is based. This basic-data report also can be used by engineers, planners, and others interested in or responsible for water-resources planning to determine the materials to be encountered (tables 3 and 4) and the yields which may be obtained from wells and test holes (tables 1 and 2) in the stratified sand and gravel that are the principal source of ground water and in bedrock. Partial and complete chemical analyses (tables 7 and 8) of these test holes and of some privately-owned wells provide information on the general quality of the water for domestic and other uses. A tabulation of existing municipal supplies, their capacity, production (table 5), and chemical quality of the water (table 6) may be used for regional planning purposes. Water-level measurements (figure 1) can be used to determine the annual fluctuations of the water table in certain types of materials. Seismic work (table 9) in the Canoe River valley, Norton, and test drilling with a power augur (tables 2 and 4) were done for the Geological Survey as  part of the investigation.

  17. Passive PE Sampling in Support of In Situ Remediation of Contaminated Sediments

    DTIC Science & Technology

    2015-08-01

    control RPD relative percent difference RSD relative standard deviation SERDP Strategic Environmental Research and Development Program SOPs...sediments from 2 stations, each at 4 PCB spike levels, for four individual congeners was 22 ± 6 % relative standard deviation ( RSD ). Also, comparison of... RSD (Table 3). However, larger congeners (e.g., congeners #153 and 180) whose approach to equilibrium is less certain, based on small fractions of

  18. Electronic structure of alloys

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Ehrenreich, H.; Schwartz, L.M.

    1976-01-01

    The description of electronic properties of binary substitutional alloys within the single particle approximation is reviewed. Emphasis is placed on a didactic exposition of the equilibrium properties of the transport and magnetic properties of such alloys. Topics covered include: multiple scattering theory; the single band alloy; formal extensions of the theory; the alloy potential; realistic model state densities; the s-d model; and the muffin tin model. 43 figures, 3 tables, 151 references. (GHT)

  19. Analysis using life tables of the major causes of death and the differences between country of birth groups in New South Wales, Australia.

    PubMed

    Weerasinghe, D P; Parr, N J; Yusuf, F

    2009-05-01

    This study used life table methods to evaluate the potential effects of reduction in major disease mortality on life expectancy in New South Wales (NSW), and the differences in cause-specific mortality between country of birth groups. The total and partial elimination of major causes of death were examined to identify the high-risk groups for community-level health planning. Life tables were used to combine the mortality rates of the NSW population at different ages into a single statistical model. Using abridged, multiple decrement and cause-elimination life tables with the mortality data for NSW in 2000-2002, broader disease groups were examined. Multiple decrement tables were generated by country of birth. The effect of the partial elimination of ischaemic heart disease (IHD) was also studied. This study found that Pacific-born men and women who reach their 30th birthday and eventually die from IHD are expected to live, on average, 10.8 and 5.8 years less, respectively, than average men and women in NSW. If IHD is eliminated as a cause of death, 7.5 years for males and 6.7 years for females would be added to life expectancy at birth. Life expectancy at birth is likely to be further increased by reducing deaths caused by diseases of the cardiovascular system, particularly among people aged over 65 years, by reducing malignant neoplasm deaths among those aged below 65 years, and by reducing deaths due to accidents, injury and poisoning, mainly among men aged 15-29 years. Further gains in life expectancy could be achieved with community-level educational programmes on lifestyle management and disease prevention.

  20. Gyrokinetic Magnetohydrodynamics and the Associated Equilibrium

    NASA Astrophysics Data System (ADS)

    Lee, W. W.; Hudson, S. R.; Ma, C. H.

    2017-10-01

    A proposed scheme for the calculations of gyrokinetic MHD and its associated equilibrium is discussed related a recent paper on the subject. The scheme is based on the time-dependent gyrokinetic vorticity equation and parallel Ohm's law, as well as the associated gyrokinetic Ampere's law. This set of equations, in terms of the electrostatic potential, ϕ, and the vector potential, ϕ , supports both spatially varying perpendicular and parallel pressure gradients and their associated currents. The MHD equilibrium can be reached when ϕ -> 0 and A becomes constant in time, which, in turn, gives ∇ . (J|| +J⊥) = 0 and the associated magnetic islands. Examples in simple cylindrical geometry will be given. The present work is partially supported by US DoE Grant DE-AC02-09CH11466.

  1. Computing diffusivities from particle models out of equilibrium

    NASA Astrophysics Data System (ADS)

    Embacher, Peter; Dirr, Nicolas; Zimmer, Johannes; Reina, Celia

    2018-04-01

    A new method is proposed to numerically extract the diffusivity of a (typically nonlinear) diffusion equation from underlying stochastic particle systems. The proposed strategy requires the system to be in local equilibrium and have Gaussian fluctuations but it is otherwise allowed to undergo arbitrary out-of-equilibrium evolutions. This could be potentially relevant for particle data obtained from experimental applications. The key idea underlying the method is that finite, yet large, particle systems formally obey stochastic partial differential equations of gradient flow type satisfying a fluctuation-dissipation relation. The strategy is here applied to three classic particle models, namely independent random walkers, a zero-range process and a symmetric simple exclusion process in one space dimension, to allow the comparison with analytic solutions.

  2. 40 CFR Table 8 to Subpart Ffff of... - Partially Soluble Hazardous Air Pollutants

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... acrylate 140885 34. Ethylbenzene 100414 35. Ethylene oxide 75218 36. Ethylidene dichloride 75343 37.... Methyl-t-butyl ether 1634044 42. Methylene chloride 75092 43. N-hexane 110543 44. N,N-dimethylaniline...

  3. 40 CFR Table 7 to Subpart Hhhhh of... - Partially Soluble Hazardous Air Pollutants

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    .... Methyl methacrylate 80626 42. Methyl-t-butyl ether 1634044 43. Methylene chloride 75092 44. N-hexane 110543 45. N,N-dimethylaniline 121697 46. Naphthalene 91203 47. Phosgene 75445 48. Propionaldehyde 123386...

  4. 40 CFR Table 7 to Subpart Hhhhh of... - Partially Soluble Hazardous Air Pollutants

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    .... Methyl methacrylate 80626 42. Methyl-t-butyl ether 1634044 43. Methylene chloride 75092 44. N-hexane 110543 45. N,N-dimethylaniline 121697 46. Naphthalene 91203 47. Phosgene 75445 48. Propionaldehyde 123386...

  5. 40 CFR Table 8 to Subpart Ffff of... - Partially Soluble Hazardous Air Pollutants

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    .... Methyl methacrylate 80626 41. Methyl-t-butyl ether 1634044 42. Methylene chloride 75092 43. N-hexane 110543 44. N,N-dimethylaniline 121697 45. Naphthalene 91203 46. Phosgene 75445 47. Propionaldehyde 123386...

  6. 40 CFR Table 8 to Subpart Ffff of... - Partially Soluble Hazardous Air Pollutants

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    .... Methyl methacrylate 80626 41. Methyl-t-butyl ether 1634044 42. Methylene chloride 75092 43. N-hexane 110543 44. N,N-dimethylaniline 121697 45. Naphthalene 91203 46. Phosgene 75445 47. Propionaldehyde 123386...

  7. 40 CFR Table 7 to Subpart Hhhhh of... - Partially Soluble Hazardous Air Pollutants

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    .... Methyl methacrylate 80626 42. Methyl-t-butyl ether 1634044 43. Methylene chloride 75092 44. N-hexane 110543 45. N,N-dimethylaniline 121697 46. Naphthalene 91203 47. Phosgene 75445 48. Propionaldehyde 123386...

  8. 40 CFR Table 7 to Subpart Hhhhh of... - Partially Soluble Hazardous Air Pollutants

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    .... Methyl methacrylate 80626 42. Methyl-t-butyl ether 1634044 43. Methylene chloride 75092 44. N-hexane 110543 45. N,N-dimethylaniline 121697 46. Naphthalene 91203 47. Phosgene 75445 48. Propionaldehyde 123386...

  9. 40 CFR Table 7 to Subpart Hhhhh of... - Partially Soluble Hazardous Air Pollutants

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    .... Methyl methacrylate 80626 42. Methyl-t-butyl ether 1634044 43. Methylene chloride 75092 44. N-hexane 110543 45. N,N-dimethylaniline 121697 46. Naphthalene 91203 47. Phosgene 75445 48. Propionaldehyde 123386...

  10. Agent-Centric Approach for Cybersecurity Decision-Support with Partial Observability

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Tipireddy, Ramakrishna; Chatterjee, Samrat; Paulson, Patrick R.

    Generating automated cyber resilience policies for real-world settings is a challenging research problem that must account for uncertainties in system state over time and dynamics between attackers and defenders. In addition to understanding attacker and defender motives and tools, and identifying “relevant” system and attack data, it is also critical to develop rigorous mathematical formulations representing the defender’s decision-support problem under uncertainty. Game-theoretic approaches involving cyber resource allocation optimization with Markov decision processes (MDP) have been previously proposed in the literature. Moreover, advancements in reinforcement learning approaches have motivated the development of partially observable stochastic games (POSGs) in various multi-agentmore » problem domains with partial information. Recent advances in cyber-system state space modeling have also generated interest in potential applicability of POSGs for cybersecurity. However, as is the case in strategic card games such as poker, research challenges using game-theoretic approaches for practical cyber defense applications include: 1) solving for equilibrium and designing efficient algorithms for large-scale, general problems; 2) establishing mathematical guarantees that equilibrium exists; 3) handling possible existence of multiple equilibria; and 4) exploitation of opponent weaknesses. Inspired by advances in solving strategic card games while acknowledging practical challenges associated with the use of game-theoretic approaches in cyber settings, this paper proposes an agent-centric approach for cybersecurity decision-support with partial system state observability.« less

  11. Table and charts of equilibrium normal-shock and shock-tube properties for pure carbon dioxide with velocities from 1 to 16 km/sec

    NASA Technical Reports Server (NTRS)

    Miller, C. G., III; Wilder, S. E.

    1976-01-01

    Equilibrium thermodynamic and flow properties are presented in tabulated and graphical form for moving, standing, and reflected normal shock waves in pure CO2. Properties include pressure, temperature, density, enthalpy, speed of sound, entropy, molecular weight ratio, isentropic exponent, velocity, and species mole fractions. Incident (moving) shock velocities are varied from 1 to 16 km/sec for a range of initial pressure of 5 N/sq m to 500 kN/sq m. The present results are applicable to shock tube flows and to freeflight conditions for a blunt body at high velocities. Working charts illustrating idealized shock tube performance with CO2 test gas and heated helium and hydrogen driver gases are also presented.

  12. The freedom to choose neutron star magnetic field equilibria: Table 1.

    NASA Astrophysics Data System (ADS)

    Glampedakis, Kostas; Lasky, Paul D.

    2016-12-01

    Our ability to interpret and glean useful information from the large body of observations of strongly magnetized neutron stars rests largely on our theoretical understanding of magnetic field equilibria. We answer the following question: is one free to arbitrarily prescribe magnetic equilibria such that fluid degrees of freedom can balance the equilibrium equations? We examine this question for various models for neutron star matter; from the simplest single-fluid barotrope to more realistic non-barotropic multifluid models with superfluid/superconducting components, muons and entropy. We do this for both axi- and non-axisymmetric equilibria, and in Newtonian gravity and general relativity. We show that, in axisymmetry, the most realistic model allows complete freedom in choosing a magnetic field equilibrium whereas non-axisymmetric equilibria are never completely arbitrary.

  13. Oxygen partial pressure sensor

    DOEpatents

    Dees, D.W.

    1994-09-06

    A method for detecting oxygen partial pressure and an oxygen partial pressure sensor are provided. The method for measuring oxygen partial pressure includes contacting oxygen to a solid oxide electrolyte and measuring the subsequent change in electrical conductivity of the solid oxide electrolyte. A solid oxide electrolyte is utilized that contacts both a porous electrode and a nonporous electrode. The electrical conductivity of the solid oxide electrolyte is affected when oxygen from an exhaust stream permeates through the porous electrode to establish an equilibrium of oxygen anions in the electrolyte, thereby displacing electrons throughout the electrolyte to form an electron gradient. By adapting the two electrodes to sense a voltage potential between them, the change in electrolyte conductivity due to oxygen presence can be measured. 1 fig.

  14. Oxygen partial pressure sensor

    DOEpatents

    Dees, Dennis W.

    1994-01-01

    A method for detecting oxygen partial pressure and an oxygen partial pressure sensor are provided. The method for measuring oxygen partial pressure includes contacting oxygen to a solid oxide electrolyte and measuring the subsequent change in electrical conductivity of the solid oxide electrolyte. A solid oxide electrolyte is utilized that contacts both a porous electrode and a nonporous electrode. The electrical conductivity of the solid oxide electrolyte is affected when oxygen from an exhaust stream permeates through the porous electrode to establish an equilibrium of oxygen anions in the electrolyte, thereby displacing electrons throughout the electrolyte to form an electron gradient. By adapting the two electrodes to sense a voltage potential between them, the change in electrolyte conductivity due to oxygen presence can be measured.

  15. Online Tools for Astronomy and Cosmochemistry

    NASA Technical Reports Server (NTRS)

    Meyer, B. S.

    2005-01-01

    Over the past year, the Webnucleo Group at Clemson University has been developing a web site with a number of interactive online tools for astronomy and cosmochemistry applications. The site uses SHP (Simplified Hypertext Preprocessor), which, because of its flexibility, allows us to embed almost any computer language into our web pages. For a description of SHP, please see http://www.joeldenny.com/ At our web site, an internet user may mine large and complex data sets, such as our stellar evolution models, and make graphs or tables of the results. The user may also run some of our detailed nuclear physics and astrophysics codes, such as our nuclear statistical equilibrium code, which is written in fortran and C. Again, the user may make graphs and tables and download the results.

  16. Phase equilibrium constraints on the origin of basalts, picrites, and komatiites

    NASA Astrophysics Data System (ADS)

    Herzberg, C.; O'Hara, M. J.

    1998-07-01

    Experimental phase equilibrium studies at pressures ranging from 1 atm to 10 GPa are sufficient to constrain the origin of igneous rocks formed along oceanic ridges and in hotspots. The major element geochemistry of MORB is dominated by partial crystallization at low pressures in the oceanic crust and uppermost mantle, forcing compliance with liquid compositions in low-pressure cotectic equilibrium with olivine, plagioclase and often augite too; parental magmas to MORB formed by partial melting, mixing, and pooling have not survived these effects. Similarly, picrites and komatiites can transform to basalts by partial crystallization in the crust and lithosphere. However, parental picrites and komatiites that were successful in erupting to the surface typically have compositions that can be matched to experimentally-observed anhydrous primary magmas in equilibrium with harzburgite [L+Ol+Opx] at 3.0 to 4.5 GPa. This pressure is likely to represent an average for pooled magmas that collected at the top of a plume head as it flattened below the lithosphere. There is substantial uniformity in the normative olivine content of primary magmas at all depths in a plume melt column, and this results in pooled komatiitic magmas that are equally uniform in normative olivine. However, the imposition of pressure above 3 GPa produces picrites and komatiites with variations in normative enstatite and Al 2O 3 that reveal plume potential temperature and depths of initial melting. Hotter plumes begin to melt deeper than cooler plumes, yielding picrites and komatiites that are enriched in normative enstatite and depleted in Al 2O 3 because of a deeper column within which orthopyroxene can dissolve during decompression. Pressures of initial melting span the 4 to 10 GPa range, increasing in the following order: Iceland, Hawaii, Gorgona, Belingwe, Barberton. Parental komatiites and picrites from a single plume also exhibit internal variability in normative enstatite and Al 2O 3, indicating either a poorly mixed partial melt aggregation process in the plume or the imposition of partial crystallization of olivine-orthopyroxenite on a well-mixed parental magma. Plume shape and thermal structure can also influence the petrology and geochemistry of picrites and komatiites. Liquids extracted from harzburgite residues [L+Ol+Opx] will dominate magmatism in a plume head, and can erupt to form komatiites in oceanic plateaus. Liquids extracted from garnet peridotite residues in a plume axis will gain in importance when the plume head partially solidifies and is removed from the hotspot by a moving lithosphere, as is the case for Hawaii. The paradoxical involvement of garnet indicated by the heavy rare earth elements in picrites that otherwise have a harzburgite signature in Hawaii can be explained by the mixing and collection of magmas from the plume axis. Volcanic rocks from Hawaii and Gorgona and xenoliths from cratonic mantle provide evidence for the importance of partial crystallization of plume magmas when they encounter a cold lithosphere. Harzburgite residua and olivine-orthopyroxene cumulates formed in plumes can yield compositionally distinct lithospheric mantle which is buoyant, and this could have provided an important foundation for the stabilization of the first continents.

  17. Network Terminations: A Compilation of Possible Answers.

    ERIC Educational Resources Information Center

    Wilson, John S.

    An examination of 20 library network terminations reveals five major reasons for termination: lack of adequate funding, absorption by larger networks, loosely structured governance, partial termination of services, and networks programmed for short durations. Two tables present survey data. (RAA)

  18. VizieR Online Data Catalog: Partition functions for molecules and atoms (Barklem+, 2016)

    NASA Astrophysics Data System (ADS)

    Barklem, P. S.; Collet, R.

    2016-02-01

    The results and input data are presented in the following files. Table 1 contains dissociation energies from the literature, and final adopted values, for 291 molecules. The literature values are from the compilations of Huber & Herzberg (1979, Constants of Diatomic Molecules (Van Nostrand Reinhold), Luo (2007, Comprehensive Handbook of Chemical Bond Energies (CRC Press)) and G2 theory calculations of Curtiss et al. (1991, J. Chem. Phys., 94, 7221). Table 2 contains the input data for the molecular calculations including adopted dissociation energy, nuclear spins, molecular spectroscopic constants and their sources. There are 291 files, one for each molecule, labelled by the molecule name. The various molecular spectroscopic constants are as defined in the paper. Table 4 contains the first, second and third ionisation energies for all chemical elements from H to U. The data comes from the CRC Handbook of Chemistry and Physics (Haynes, W.M. 2010, CRC Handbook of Chemistry and Physics, 91st edn. (CRC Press, Taylor and Francis Group)). Table 5a contains a list of keys to bibliographic references for the atomic energy level data that was extracted from NIST Atomic Spectra Database and used in the present work to compute atomic partition functions. The citation keys are abbreviations of the full bibliographic references which are made available in Table 5b in BibTeX format. Table 5b contains the full bibliographic references for the atomic energy level data that was extracted from the NIST Atomic Spectra Database. Table 6 contains tabulated partition function data as a function of temperature for 291 molecules. Table 7 contains tabulated equilibrium constant data as a function of temperature for 291 molecules. Table 8 contains tabulated partition function data as a function of temperature for 284 atoms and ions. The paper should be consulted for further details. (10 data files).

  19. 40 CFR Table 4 to Subpart Uuu of... - Requirements for Performance Tests for Metal HAP Emissions From Catalytic Cracking Units Not...

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... 4 of § 63.1564. 4. Option 3: Ni lb/hr a. Measure concentration of Ni and total metal HAP. Method 29 (40 CFR part 60, appendix A). b. Compute Ni emission rate (lb/hr). Equation 5 of § 63.1564. c. Determine the equilibrium catalyst Ni concentration. XRF procedure in appendix A to this subpart1; or EPA...

  20. 40 CFR Table 4 to Subpart Uuu of... - Requirements for Performance Tests for Metal HAP Emissions From Catalytic Cracking Units Not...

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... 4 of § 63.1564. 4. Option 3: Ni lb/hr a. Measure concentration of Ni and total metal HAP. Method 29 (40 CFR part 60, appendix A). b. Compute Ni emission rate (lb/hr). Equation 5 of § 63.1564. c. Determine the equilibrium catalyst Ni concentration. XRF procedure in appendix A to this subpart1; or EPA...

  1. Nonlinear Optoacoustic Underwater Sound.

    DTIC Science & Technology

    1988-01-11

    sufficiently high plasma densities, the plasma itself may act as an acoustic ] amplifier, channeling electronic energy into acoustic energy. The shock pulse... channeled into the production of electron charge carriers, the law of conservation of energy dictates that the upperbound of the electron yield must be...temperature of the water by approximately 10C from room 100 - t bLT WV *A% IV * , . . ..1- KV7 b * .% r.- V-V I 7 TABLE V 0 EQUILIBRIUM BLAST MODEL CASE

  2. Electron transfer between cytochrome. alpha. and copper A in cytochrome c oxidase: A perturbed equilibrium study

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Morgan, J.E.; Li, P.M.; Jang, D.J.

    1989-08-22

    Intramolecular electron transfer in partially reduced cytochrome c oxidase has been studied by the perturbed equilibrium method. The authors have prepared a three-electron-reduced, CO-inhibited form of the enzyme in which cytochrome a and copper A are partially reduced and in an intramolecular redox equilibrium. When these samples were irradiated with a nitrogen laser to photodissociate the bound CO, changes in absorbance at 598 and 830 nm were observed which were consistent with a fast electron transfer from cytochrome a to copper A. The absorbance changes at 598 nm gave an apparent rate of 17,000 {plus minus} 2,000 s{sup {minus}1} (1more » {sigma}), at pH 7.0 and 25.5{degree}C. These changes were not observed in either the CO mixed-valence or the CO-inhibited fully reduced forms of the enzyme. The rate was fastest at about pH 8.0, falling off toward both lower and higher pHs. There was a small but clear temperature dependence. The process was also observed in the cytochrome c-cytochrome c oxidase high-affinity complex. The electron equilibration measured between cytochrome {alpha} and copper A is far faster than any rate measured or inferred previously for this process.« less

  3. The free energies of partially open coronal magnetic fields

    NASA Technical Reports Server (NTRS)

    Low, B. C.; Smith, D. F.

    1993-01-01

    A simple model of the low corona is examined in terms of a static polytropic atmosphere in equilibrium with a global magnetic field. The question posed is whether magnetostatic states with partially open magnetic fields may contain magnetic energies in excess of those in fully open magnetic fields. Based on the analysis presented here, it is concluded that the cross-field electric currents in the pre-eruption corona are a viable source of the bulk of the energies in a mass ejection and its associated flare.

  4. Vehicle operating costs, fuel consumption, and pavement type condition factors

    DOT National Transportation Integrated Search

    1982-06-01

    This report presents updated vehicle operating cost tables which may be used by a highway agency for estimation of vehicle operating costs as a function of operational and roadway variables. These results, partially based on fuel consumption tests on...

  5. Map showing the depth to the base of the deepest ice-bearing permafrost as determined from well logs, North Slope, Alaska

    USGS Publications Warehouse

    Collett, T.S.; Bird, K.J.; Kvenvolden, K.A.; Magoon, L.B.

    1989-01-01

    Because gas hydrates from within a limited temperature range, subsurface equilibrium temperature data are necessary to calculate the depth and thickness of the gas-hydrate stability field.  Acquiring these data is difficult because drilling activity often disrupts equilibrium temperatures in the subsurface, and a well mush lie undisturbed until thermal equilibrium is reestablished (Lachenbruch and Brewer, 1959).  On the North Slope if Akaska, a series of 46 oil and gas exploratory wells, which were considered to be near thermal equilibrium (Lachenbruch and others, 1982; 1987), were surveyed with high-resolution temperature devices (see table 1).  However, several thousand other exploratory and production wells have been drilled on the North Slope, and although they do not include temperature profiles, their geophysical logs often allow descrimination between ice-bearing and non-ice-bearing strata.  At the outset of this study, the coincidence of the base of ice-bearing strata being near the same depth as the 0°C isotherm at Prudhoe Bay (Lachenbruch and others, 1982) appeared to offer an opportunity to quickly and inexpensively expand the size of our subsurface temperature data base merely by using well logs to identify the base of the ice-bearing strata.

  6. Exponential 6 parameterization for the JCZ3-EOS

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    McGee, B.C.; Hobbs, M.L.; Baer, M.R.

    1998-07-01

    A database has been created for use with the Jacobs-Cowperthwaite-Zwisler-3 equation-of-state (JCZ3-EOS) to determine thermochemical equilibrium for detonation and expansion states of energetic materials. The JCZ3-EOS uses the exponential 6 intermolecular potential function to describe interactions between molecules. All product species are characterized by r*, the radius of the minimum pair potential energy, and {var_epsilon}/k, the well depth energy normalized by Boltzmann`s constant. These parameters constitute the JCZS (S for Sandia) EOS database describing 750 gases (including all the gases in the JANNAF tables), and have been obtained by using Lennard-Jones potential parameters, a corresponding states theory, pure liquid shockmore » Hugoniot data, and fit values using an empirical EOS. This database can be used with the CHEETAH 1.40 or CHEETAH 2.0 interface to the TIGER computer program that predicts the equilibrium state of gas- and condensed-phase product species. The large JCZS-EOS database permits intermolecular potential based equilibrium calculations of energetic materials with complex elemental composition.« less

  7. Ablation Predictions for Carbonaceous Materials Using Two Databases for Species Thermodynamics

    NASA Technical Reports Server (NTRS)

    Milos, F. S.; Chen, Y.-K.

    2013-01-01

    During previous work at NASA Ames Research Center, most ablation predictions were obtained using a species thermodynamics database derived primarily from the JANAF thermochemical tables. However, the chemical equilibrium with applications thermodynamics database, also used by NASA, is considered more up to date. In this work, ablation analyses were performed for carbon and carbon phenolic materials using both sets of species thermodynamics. The ablation predictions are comparable at low and moderate heat fluxes, where the dominant mechanism is carbon oxidation. For high heat fluxes where sublimation is important, the predictions differ, with the chemical equilibrium with applications model predicting a lower ablation rate. The disagreement is greater for carbon phenolic than for carbon, and this difference is attributed to hydrocarbon species that may contribute to the ablation rate. Sample calculations for representative Orion and Stardust environments show significant differences only in the sublimation regime. For Stardust, if the calculations include a nominal environmental uncertainty for aeroheating, then the chemical equilibrium with applications model predicts a range of recession that is consistent with measurements for both heatshield cores.

  8. Analytical modeling of the temporal evolution of hot spot temperatures in silicon solar cells

    NASA Astrophysics Data System (ADS)

    Wasmer, Sven; Rajsrima, Narong; Geisemeyer, Ino; Fertig, Fabian; Greulich, Johannes Michael; Rein, Stefan

    2018-03-01

    We present an approach to predict the equilibrium temperature of hot spots in crystalline silicon solar cells based on the analysis of their temporal evolution right after turning on a reverse bias. For this end, we derive an analytical expression for the time-dependent heat diffusion of a breakdown channel that is assumed to be cylindrical. We validate this by means of thermography imaging of hot spots right after turning on a reverse bias. The expression allows to be used to extract hot spot powers and radii from short-term measurements, targeting application in inline solar cell characterization. The extracted hot spot powers are validated at the hands of long-term dark lock-in thermography imaging. Using a look-up table of expected equilibrium temperatures determined by numerical and analytical simulations, we utilize the determined hot spot properties to predict the equilibrium temperatures of about 100 industrial aluminum back-surface field solar cells and achieve a high correlation coefficient of 0.86 and a mean absolute error of only 3.3 K.

  9. Cycling of greenhouse gases as a function of groundwater level in a floodplain - carbon dioxide, nitrous oxide and methane: Implications for Biogeochemical Change in a Warming World

    NASA Astrophysics Data System (ADS)

    Bill, M.; Conrad, M. E.; Tokunaga, T. K.; Hobson, C.; Williams, K. H.

    2016-12-01

    Floodplain sediment-water systems play an important role in carbon dioxide, nitrous oxide and methane greenhouse gas cycling. Changes in temperature and precipitation can alter biogeochemical equilibrium as well as production and consumption of greenhouse gases. We monitored CO2, N2O, CH4 greenhouse gas concentrations and C, O, and N stable isotope variations over a period of 4 years in a cross section of five wells located with increasing distance from the Colorado River. Pore space of partially saturated sediments located above an alluvial aquifer was sampled in vertically resolved profiles from 0.5 m to 3 m depth at a periodicity of one month to 2 weeks. Gas concentrations and stable isotopic signatures show annual-scale fluctuations. From 2013 to 2016 during cold seasons, low δ13C of CO2 ( -24‰) and high δ15N of N2O ( -5‰) and minimum concentrations in CO2 (< 5%v), N2O (< 5ppmv) and CH4 (< 0.5ppmv) coincide with low water table elevation and low temperature. At the beginning of summer, which corresponds to maximum water table elevation, we observed the highest concentrations of N2O ( 50ppmv) and of CO2 ( 5.5%v). Low δ15N ( -16‰) and relatively high δ13C ( -21‰) values were also observed for the summer season. CH4 was observed only in the well closest to the river (7ppmv). The variation of CO2, N2O and CH4 concentrations and δ values suggest changes in reducing/oxidizing microbial activity. Strongest biologically mediated reduction is associated with the highest water table, which typically induces reducing conditions. The maximum water elevation coincides with the annual snowmelt in the Rocky Mountains. Climate change directly impacts on biogeochemical cycling in the floodplain by affecting stream and river water discharge. At local and global scales, a drier and warmer climate will decrease N2O and CH4 production. A wetter climate induces higher stream and river water discharge, which will increase the zone and magnitude of N2O and CH4 production.

  10. Optimal control of a coupled partial and ordinary differential equations system for the assimilation of polarimetry Stokes vector measurements in tokamak free-boundary equilibrium reconstruction with application to ITER

    NASA Astrophysics Data System (ADS)

    Faugeras, Blaise; Blum, Jacques; Heumann, Holger; Boulbe, Cédric

    2017-08-01

    The modelization of polarimetry Faraday rotation measurements commonly used in tokamak plasma equilibrium reconstruction codes is an approximation to the Stokes model. This approximation is not valid for the foreseen ITER scenarios where high current and electron density plasma regimes are expected. In this work a method enabling the consistent resolution of the inverse equilibrium reconstruction problem in the framework of non-linear free-boundary equilibrium coupled to the Stokes model equation for polarimetry is provided. Using optimal control theory we derive the optimality system for this inverse problem. A sequential quadratic programming (SQP) method is proposed for its numerical resolution. Numerical experiments with noisy synthetic measurements in the ITER tokamak configuration for two test cases, the second of which is an H-mode plasma, show that the method is efficient and that the accuracy of the identification of the unknown profile functions is improved compared to the use of classical Faraday measurements.

  11. Does shaking increase the pressure inside a bottle of champagne?

    PubMed

    Vreme, A; Pouligny, B; Nadal, F; Liger-Belair, G

    2015-02-01

    Colas, beers and sparkling wines are all concentrated solutions of carbon dioxide in aqueous solvents. Any such carbonated liquid is ordinarily conditioned inside a closed bottle or a metal can as a liquid-gas 2-phase system. At thermodynamic equilibrium, the partial pressure of carbon-dioxide in the gas phase and its concentration in the liquid are proportional (Henry's law). In practical conditions and use (transport, opening of the container, exterior temperature change, etc.), Henry's equilibrium can be perturbed. The goal of this paper is to describe and understand how the system responds to such perturbations and evolves towards a new equilibrium state. Formally, we investigate the dynamics around Henry's equilibrium of a closed system, through dedicated experiments and modeling. We focus on the response to a sudden pressure change and to mechanical shaking (the latter point inspired the article's title). Observations are rationalized through basic considerations including molecular diffusion, bubble dynamics (based on Epstein-Plesset theory) and chemi-convective hydrodynamic instabilities. Copyright © 2014 Elsevier Inc. All rights reserved.

  12. Experimental Investigation of Gas/Slag/Matte/Spinel Equilibria in the Cu-Fe-O-S-Si System at 1473 K (1200 °C) and P(SO2) = 0.25 atm

    NASA Astrophysics Data System (ADS)

    Hidayat, Taufiq; Fallah-Mehrjardi, Ata; Hayes, Peter C.; Jak, Evgueni

    2018-04-01

    New experimental data were obtained on the gas/slag/matte/spinel equilibria in the Cu-Fe-O-S-Si system at 1473 K (1200 °C) and P(SO2) = 0.25 atm covering Cu concentrations in matte between 42 and 78 wt pct Cu. Accurate measurements were obtained using high-temperature equilibration and the rapid quenching technique, followed by electron-probe X-ray microanalysis of equilibrium phase compositions. The use of spinel substrates made to support the samples ensures equilibrium with this primary phase solid, eliminates crucible contamination, and facilitates direct gas-condensed phase equilibrium and high quenching rates. Particular attention was given to the confirmation of the achievement of equilibrium. The results quantify the relationship between Cu in matte and oxygen partial pressure, sulfur in matte, oxygen in matte, Fe/SiO2 at slag liquidus, sulfur in slag, and dissolved copper in slag.

  13. Statistical approach to partial equilibrium analysis

    NASA Astrophysics Data System (ADS)

    Wang, Yougui; Stanley, H. E.

    2009-04-01

    A statistical approach to market equilibrium and efficiency analysis is proposed in this paper. One factor that governs the exchange decisions of traders in a market, named willingness price, is highlighted and constitutes the whole theory. The supply and demand functions are formulated as the distributions of corresponding willing exchange over the willingness price. The laws of supply and demand can be derived directly from these distributions. The characteristics of excess demand function are analyzed and the necessary conditions for the existence and uniqueness of equilibrium point of the market are specified. The rationing rates of buyers and sellers are introduced to describe the ratio of realized exchange to willing exchange, and their dependence on the market price is studied in the cases of shortage and surplus. The realized market surplus, which is the criterion of market efficiency, can be written as a function of the distributions of willing exchange and the rationing rates. With this approach we can strictly prove that a market is efficient in the state of equilibrium.

  14. Reactive solute transport in streams: 1. Development of an equilibrium- based model

    USGS Publications Warehouse

    Runkel, Robert L.; Bencala, Kenneth E.; Broshears, Robert E.; Chapra, Steven C.

    1996-01-01

    An equilibrium-based solute transport model is developed for the simulation of trace metal fate and transport in streams. The model is formed by coupling a solute transport model with a chemical equilibrium submodel based on MINTEQ. The solute transport model considers the physical processes of advection, dispersion, lateral inflow, and transient storage, while the equilibrium submodel considers the speciation and complexation of aqueous species, precipitation/dissolution and sorption. Within the model, reactions in the water column may result in the formation of solid phases (precipitates and sorbed species) that are subject to downstream transport and settling processes. Solid phases on the streambed may also interact with the water column through dissolution and sorption/desorption reactions. Consideration of both mobile (water-borne) and immobile (streambed) solid phases requires a unique set of governing differential equations and solution techniques that are developed herein. The partial differential equations describing physical transport and the algebraic equations describing chemical equilibria are coupled using the sequential iteration approach.

  15. Finite-size versus interface-proximity effects in thin-film epitaxial SrTiO3

    NASA Astrophysics Data System (ADS)

    De Souza, R. A.; Gunkel, F.; Hoffmann-Eifert, S.; Dittmann, R.

    2014-06-01

    The equilibrium electrical conductivity of epitaxial SrTiO3 (STO) thin films was investigated as a function of temperature, 950≤ T/K ≤1100, and oxygen partial pressure, 10-23≤ pO2/bar ≤1. Compared with single-crystal STO, nanoscale thin-film STO exhibited with decreasing film thickness an increasingly enhanced electronic conductivity under highly reducing conditions, with a corresponding decrease in the activation enthalpy of conduction. This implies substantial modification of STO's point-defect thermodynamics for nanoscale film thicknesses. We argue, however, against such a finite-size effect and for an interface-proximity effect. Indeed, assuming trapping of oxygen vacancies at the STO surface and concomitant depletion of oxygen vacancies—and accumulation of electrons—in an equilibrium surface space-charge layer, we are able to predict quantitatively the conductivity as a function of temperature, oxygen partial pressure, and film thickness. Particularly complex behavior is predicted for ultrathin films that are consumed entirely by space charge.

  16. SSMILES.

    ERIC Educational Resources Information Center

    Sunal, Dennis W., Ed.; Tracy, Dyanne M., Ed.

    1993-01-01

    Describes an activity in which the students utilize the mathematics concepts of ratio, proportion, and data tabulation to examine the relationship between air pressure, temperature, and humidity. Students learn to approximate partial pressure by using humidity and temperature readings and by interpolating from the vapor pressure-temperature table.…

  17. Design and dosimetry of small animal radiation facilities

    NASA Astrophysics Data System (ADS)

    Rodriguez, Manuel R.

    The aim of this work was to develop an irradiation system for radiobiology studies. We designed a novel image-guided micro-irradiator capable of partial-body zebrafish embryo irradiation. The radiation source is a 50 kV photon beam from a miniature x-ray source (Xoft Inc., CA). The source is inserted in a cylindrical brass collimator, 3 cm in diameter and 3 cm in length. The collimator has a 1 mm-diameter pinhole along the longitudinal axis, which provides a well-focused beam with a sharp penumbra. A photodiode is installed at one exit of the pinhole collimator to monitor the photon dose rate. The source with the collimator is attached under a movable table. A video camera, connected to the computer, is placed above the movable table to record position of the specimens in relation to the pinhole collimator. The captured images are analyzed, and the relative distances between the specimens and the pinhole are calculated. The coordinates are sent to the computer-controlled movable table to accurately position the specimens in the beam. Monte Carlo simulations were performed to characterize dosimetric properties of the system, to determine dosimetric sensitivity, and to help in the design. The image-guidance and high precision of the movable table enable very accurate specimen position. The beam monitoring system provides accurate, fast and easy dose determination. Portability and self-shielding make this system suitable for any radiobiology laboratory. This novel micro-irradiator is appropriate for partial irradiation of zebrafish embryos; however its potential use is much wider like irradiation of cell cultures or other small specimens.

  18. Recommendations for numerical solution of reinforced-panel and fuselage-ring problems

    NASA Technical Reports Server (NTRS)

    Hoff, N J; Libby, Paul A

    1949-01-01

    Procedures are recommended for solving the equations of equilibrium of reinforced panels and isolated fuselage rings as represented by the external loads and the operations table established according to Southwell's method. From the solution of these equations the stress distribution can be easily determined. The method of systematic relaxations, the matrix-calculus method, and several other methods applicable in special cases are discussed. Definite recommendations are made for obtaining the solution of reinforced-panel problems which are generally designated as shear lag problems. The procedures recommended are demonstrated in the analysis of a number of panels. In the case of fuselage rings it is not possible to make definite recommendations for the solution of the equilibrium equations for all rings and loadings. However, suggestions based on the latest experience are made and demonstrated on several rings.

  19. Tables and charts of equilibrium normal shock and shock tube solutions for pure CO2 with velocities to 16 km/second

    NASA Technical Reports Server (NTRS)

    Miller, C. G., III; Wilder, S. E.

    1974-01-01

    Equilibrium thermodynamic and flow properties are presented in tabulated and graphical form for moving, standing, and reflected normal shock waves in pure CO2, representative of Mars and Venus atmospheres. Properties include pressure, temperature, density, enthalpy, speed of sound, entropy, molecular weight ratio, isentropic exponent, velocity and species mole fractions. Incident (moving) shock velocities are varied from 1 to 16 km/sec for a range of initial pressure of 5 Newtons per square meter to 500 kilo Newtons per square meter. The present results are applicable to shock tube flows, and to free-flight conditions for a blunt body at high velocities. Working charts illustrating idealized shock-tube performance with CO2 test gas and heated helium and hydrogen driver gases are also presented.

  20. Thermodynamics of cell adhesion. II. Freely mobile repellers.

    PubMed Central

    Torney, D C; Dembo, M; Bell, G I

    1986-01-01

    The equilibrium adhesion of a cell or vesicle to a substrate is analyzed in a theoretical model in which two types of mobile molecules in the cell membrane are of interest: receptors that can form bonds with fixed ligands in the substrate and repellers that repel the substrate. If the repulsion between the repeller molecule and substrate is greater than kT, there is substantial redistribution of the repellers from the contact area. Coexisting equilibrium states are observed having comparable free energies (a) with unstretched bonds and repeller redistribution and (b) with stretched bonds and partial redistribution. PMID:3955182

  1. Heat transfer in porous medium embedded with vertical plate: Non-equilibrium approach - Part A

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Badruddin, Irfan Anjum; Quadir, G. A.

    2016-06-08

    Heat transfer in a porous medium embedded with vertical flat plate is investigated by using thermal non-equilibrium model. Darcy model is employed to simulate the flow inside porous medium. It is assumed that the heat transfer takes place by natural convection and radiation. The vertical plate is maintained at isothermal temperature. The governing partial differential equations are converted into non-dimensional form and solved numerically using finite element method. Results are presented in terms of isotherms and streamlines for various parameters such as heat transfer coefficient parameter, thermal conductivity ratio, and radiation parameter.

  2. Quantum statistical mechanics of dense partially ionized hydrogen

    NASA Technical Reports Server (NTRS)

    Dewitt, H. E.; Rogers, F. J.

    1972-01-01

    The theory of dense hydrogen plasmas beginning with the two component quantum grand partition function is reviewed. It is shown that ionization equilibrium and molecular dissociation equilibrium can be treated in the same manner with proper consideration of all two-body states. A quantum perturbation expansion is used to give an accurate calculation of the equation of state of the gas for any degree of dissociation and ionization. The statistical mechanical calculation of the plasma equation of state is intended for stellar interiors. The general approach is extended to the calculation of the equation of state of the outer layers of large planets.

  3. Electron-Impact Excitation Cross Sections for Modeling Non-Equilibrium Gas

    NASA Technical Reports Server (NTRS)

    Huo, Winifred M.; Liu, Yen; Panesi, Marco; Munafo, Alessandro; Wray, Alan; Carbon, Duane F.

    2015-01-01

    In order to provide a database for modeling hypersonic entry in a partially ionized gas under non-equilibrium, the electron-impact excitation cross sections of atoms have been calculated using perturbation theory. The energy levels covered in the calculation are retrieved from the level list in the HyperRad code. The downstream flow-field is determined by solving a set of continuity equations for each component. The individual structure of each energy level is included. These equations are then complemented by the Euler system of equations. Finally, the radiation field is modeled by solving the radiative transfer equation.

  4. A reaction-based paradigm to model reactive chemical transport in groundwater with general kinetic and equilibrium reactions.

    PubMed

    Zhang, Fan; Yeh, Gour-Tsyh; Parker, Jack C; Brooks, Scott C; Pace, Molly N; Kim, Young-Jin; Jardine, Philip M; Watson, David B

    2007-06-16

    This paper presents a reaction-based water quality transport model in subsurface flow systems. Transport of chemical species with a variety of chemical and physical processes is mathematically described by M partial differential equations (PDEs). Decomposition via Gauss-Jordan column reduction of the reaction network transforms M species reactive transport equations into two sets of equations: a set of thermodynamic equilibrium equations representing N(E) equilibrium reactions and a set of reactive transport equations of M-N(E) kinetic-variables involving no equilibrium reactions (a kinetic-variable is a linear combination of species). The elimination of equilibrium reactions from reactive transport equations allows robust and efficient numerical integration. The model solves the PDEs of kinetic-variables rather than individual chemical species, which reduces the number of reactive transport equations and simplifies the reaction terms in the equations. A variety of numerical methods are investigated for solving the coupled transport and reaction equations. Simulation comparisons with exact solutions were performed to verify numerical accuracy and assess the effectiveness of various numerical strategies to deal with different application circumstances. Two validation examples involving simulations of uranium transport in soil columns are presented to evaluate the ability of the model to simulate reactive transport with complex reaction networks involving both kinetic and equilibrium reactions.

  5. Stationary table CT dosimetry and anomalous scanner-reported values of CTDI{sub vol}

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Dixon, Robert L., E-mail: rdixon@wfubmc.edu; Boone, John M.

    2014-01-15

    Purpose: Anomalous, scanner-reported values of CTDI{sub vol} for stationary phantom/table protocols (having elevated values of CTDI{sub vol} over 300% higher than the actual dose to the phantom) have been observed; which are well-beyond the typical accuracy expected of CTDI{sub vol} as a phantom dose. Recognition of these outliers as “bad data” is important to users of CT dose index tracking systems (e.g., ACR DIR), and a method for recognition and correction is provided. Methods: Rigorous methods and equations are presented which describe the dose distributions for stationary-table CT. A comparison with formulae for scanner-reported values of CTDI{sub vol} clearly identifiesmore » the source of these anomalies. Results: For the stationary table, use of the CTDI{sub 100} formula (applicable to a moving phantom only) overestimates the dose due to extra scatter and also includes an overbeaming correction, both of which are nonexistent when the phantom (or patient) is held stationary. The reported DLP remains robust for the stationary phantom. Conclusions: The CTDI-paradigm does not apply in the case of a stationary phantom and simpler nonintegral equations suffice. A method of correction of the currently reported CTDI{sub vol} using the approach-to-equilibrium formula H(a) and an overbeaming correction factor serves to scale the reported CTDI{sub vol} values to more accurate levels for stationary-table CT, as well as serving as an indicator in the detection of “bad data.”.« less

  6. An internally consistent set of thermodynamic data for twentyone CaO-Al2O3-SiO2- H2O phases by linear parametric programming

    NASA Astrophysics Data System (ADS)

    Halbach, Heiner; Chatterjee, Niranjan D.

    1984-11-01

    The technique of linear parametric programming has been applied to derive sets of internally consistent thermodynamic data for 21 condensed phases of the quaternary system CaO-Al2O3-SiO2-H2O (CASH) (Table 4). This was achieved by simultaneously processing: a) calorimetric data for 16 of these phases (Table 1), and b) experimental phase equilibria reversal brackets for 27 reactions (Table 3) involving these phases. Calculation of equilibrium P-T curves of several arbitrarily picked reactions employing the preferred set of internally consistent thermodynamic data from Table 4 shows that the input brackets are invariably satisfied by the calculations (Fig. 2a). By contrast, the same equilibria calculated on the basis of a set of thermodynamic data derived by applying statistical methods to a large body of comparable input data (Haas et al. 1981; Hemingway et al. 1982) do not necessarily agree with the experimental reversal brackets. Prediction of some experimentally investigated phase relations not included into the linear programming input database also appears to be remarkably successful. Indications are, therefore, that the thermodynamic data listed in Table 4 may be used with confidence to predict geologic phase relations in the CASH system with considerable accuracy. For such calculated phase diagrams and their petrological implications, the reader's attention is drawn to the paper by Chatterjee et al. (1984).

  7. Ablation, Thermal Response, and Chemistry Program for Analysis of Thermal Protection Systems

    NASA Technical Reports Server (NTRS)

    Milos, Frank S.; Chen, Yih-Kanq

    2010-01-01

    In previous work, the authors documented the Multicomponent Ablation Thermochemistry (MAT) and Fully Implicit Ablation and Thermal response (FIAT) programs. In this work, key features from MAT and FIAT were combined to create the new Fully Implicit Ablation, Thermal response, and Chemistry (FIATC) program. FIATC is fully compatible with FIAT (version 2.5) but has expanded capabilities to compute the multispecies surface chemistry and ablation rate as part of the surface energy balance. This new methodology eliminates B' tables, provides blown species fractions as a function of time, and enables calculations that would otherwise be impractical (e.g. 4+ dimensional tables) such as pyrolysis and ablation with kinetic rates or unequal diffusion coefficients. Equations and solution procedures are presented, then representative calculations of equilibrium and finite-rate ablation in flight and ground-test environments are discussed.

  8. Some Theoretical Aspects of Nonzero Sum Differential Games and Applications to Combat Problems

    DTIC Science & Technology

    1971-06-01

    the Equilibrium Solution . 7 Hamilton-Jacobi-Bellman Partial Differential Equations ............. .............. 9 Influence Function Differential...Linearly .......... ............ 18 Problem Statement .......... ............ 18 Formulation of LJB Equations, Influence Function Equations and the TPBVP...19 Control Lawe . . .. ...... ........... 21 Conditions for Influence Function Continuity along Singular Surfaces

  9. Split-flow regeneration in absorptive air separation

    DOEpatents

    Weimer, Robert F.

    1987-01-01

    A chemical absorptive separation of air in multiple stage of absorption and desorption is performed with partial recycle of absorbent between stages of desorption necessary to match equilibrium conditions in the various stages of absorption. This allows reduced absorbent flow, reduced energy demand and reduced capital costs.

  10. 26 CFR 1.6015-0 - Table of contents.

    Code of Federal Regulations, 2011 CFR

    2011-04-01

    ... all qualifying joint filers. (a) In general. (b) Understatement. (c) Knowledge or reason to know. (d...) Actual knowledge. (i) In general. (A) Omitted income. (B) Deduction or credit. (1) Erroneous deductions in general. (2) Fictitious or inflated deduction. (ii) Partial knowledge. (iii) Knowledge of the...

  11. A semi-analytical solution for slug tests in an unconfined aquifer considering unsaturated flow

    NASA Astrophysics Data System (ADS)

    Sun, Hongbing

    2016-01-01

    A semi-analytical solution considering the vertical unsaturated flow is developed for groundwater flow in response to a slug test in an unconfined aquifer in Laplace space. The new solution incorporates the effects of partial penetrating, anisotropy, vertical unsaturated flow, and a moving water table boundary. Compared to the Kansas Geological Survey (KGS) model, the new solution can significantly improve the fittings of the modeled to the measured hydraulic heads at the late stage of slug tests in an unconfined aquifer, particularly when the slug well has a partially submerged screen and moisture drainage above the water table is significant. The radial hydraulic conductivities estimated with the new solution are comparable to those from the KGS, Bouwer and Rice, and Hvorslev methods. In addition, the new solution also can be used to examine the vertical conductivity, specific storage, specific yield, and the moisture retention parameters in an unconfined aquifer based on slug test data.

  12. Solidification Sequence of Spray-Formed Steels

    NASA Astrophysics Data System (ADS)

    Zepon, Guilherme; Ellendt, Nils; Uhlenwinkel, Volker; Bolfarini, Claudemiro

    2016-02-01

    Solidification in spray-forming is still an open discussion in the atomization and deposition area. This paper proposes a solidification model based on the equilibrium solidification path of alloys. The main assumptions of the model are that the deposition zone temperature must be above the alloy's solidus temperature and that the equilibrium liquid fraction at this temperature is reached, which involves partial remelting and/or redissolution of completely solidified droplets. When the deposition zone is cooled, solidification of the remaining liquid takes place under near equilibrium conditions. Scanning electron microscopy (SEM) and optical microscopy (OM) were used to analyze the microstructures of two different spray-formed steel grades: (1) boron modified supermartensitic stainless steel (SMSS) and (2) D2 tool steel. The microstructures were analyzed to determine the sequence of phase formation during solidification. In both cases, the solidification model proposed was validated.

  13. Lower body negative pressure chamber: Design and specifications for tilt-table mounting

    NASA Technical Reports Server (NTRS)

    Salamacha, Laura; Gundo, D.; Mulenburg, G. M.; Greenleaf, J. E.

    1995-01-01

    Specifications for a lower body negative pressure chamber for mounting on a tilting table are presented. The main plate is made from HEXEL honeycomb board 1.0 inch thick. The plate, supported at three edges, will be subjected to a uniform pressure differential of -4.7 lb/sq in. A semi-cylindrical Plexiglass top (chamber) is attached to the main plate; the pressure within the chamber will be about 10lb/sq in during operation. The stresses incurred by the main plate with this partial vacuum were calculated. All linear dimensions are in inches.

  14. Supervisory Control of Multiple Uninhabited Systems - Methodologies and Enabling Human-Robot Interface Technologies (Commande et surveillance de multiples systemes sans pilote - Methodologies et technologies habilitantes d’interfaces homme-machine)

    DTIC Science & Technology

    2012-12-01

    FRANCE 6.1 DATES SMAART (2006 – 2008) and SUSIE (2009 – 2011). 6.2 LOCATION Brest – Nancy – Paris (France). 6.3 SCENARIO/TASKS The setting...Agency (RTA), a dedicated staff with its headquarters in Neuilly, near Paris , France. In order to facilitate contacts with the military users and...Mission Delay for the Helicopter 8-12 Table 8-2 Assistant Interventions and Commander’s Reactions 8-13 Table 10-1 Partial LOA Matrix as Originally

  15. Numerical method based on the lattice Boltzmann model for the Fisher equation.

    PubMed

    Yan, Guangwu; Zhang, Jianying; Dong, Yinfeng

    2008-06-01

    In this paper, a lattice Boltzmann model for the Fisher equation is proposed. First, the Chapman-Enskog expansion and the multiscale time expansion are used to describe higher-order moment of equilibrium distribution functions and a series of partial differential equations in different time scales. Second, the modified partial differential equation of the Fisher equation with the higher-order truncation error is obtained. Third, comparison between numerical results of the lattice Boltzmann models and exact solution is given. The numerical results agree well with the classical ones.

  16. Utilizing CFD for Prediction of HD1.3 Pressure Loads in a Cell with Venting

    DTIC Science & Technology

    2010-07-01

    room. The gas load is a result of the heat released during the explosion and afterburning of explosives that was not consumed by the initial...Structural Systems Design Guide HNDED-CS-93-72 specifies that all HD 1.3 in a room will be summed and converted to an equivalent TNT mass (based on...the H2 and CO are shown in Table 5. The Pre- Afterburning quantities are based on the chemical equilibrium calculations performed in the AFCESI code

  17. Tensiometer for shallow or deep measurements including vadose zone and aquifers

    DOEpatents

    Faybishenko, B.

    1999-08-24

    A two cell tensiometer is described in which water level in the lower cell is maintained at a relatively constant height, and in equilibrium with the water pressure of materials that surround the tensiometer. An isolated volume of air in the lower cell changes pressure proportionately to the changing water pressure of the materials that surround the tensiometer. The air pressure is measured remotely. The tensiometer can be used in drying as well as wetting cycles above and below the water table. 8 figs.

  18. Tensiometer for shallow or deep measurements including vadose zone and aquifers

    DOEpatents

    Faybishenko, Boris

    1999-01-01

    A two cell tensiometer is described in which water level in the lower cell is maintained at a relatively constant height, and in equilibrium with the water pressure of materials that surround the tensiometer. An isolated volume of air in the lower cell changes pressure proportionately to the changing water pressure of the materials that surround the tensiometer. The air pressure is measured remotely. The tensiometer can be used in drying as well as wetting cycles above and below the water table.

  19. Split-flow regeneration in absorptive air separation

    DOEpatents

    Weimer, R.F.

    1987-11-24

    A chemical absorptive separation of air in multiple stage of absorption and desorption is performed with partial recycle of absorbent between stages of desorption necessary to match equilibrium conditions in the various stages of absorption. This allows reduced absorbent flow, reduced energy demand and reduced capital costs. 4 figs.

  20. A demonstration experiment for studying the properties of saturated vapor

    NASA Astrophysics Data System (ADS)

    Grebenev, Igor V.; Lebedeva, Olga V.; Polushkina, Svetlana V.

    2017-11-01

    The paper proposes an important demonstration experiment that can be used at secondary schools in physics. The described experiment helps students learn the main concepts of the topic ‘saturated vapor’, namely, evaporation, condensation, dynamic equilibrium, saturation vapor, partial pressure, and the dependence of saturated vapor pressure on temperature.

  1. 40 CFR 81.329 - Nevada.

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... classified Better than national standards (Township Range): Clark County: Las Vegas Valley (212)(15-24S, 56... County refers to 27 hydrographic areas either entirely or partially located within Clark County as shown... (September 1971), excluding the two designated areas in Clark County specifically listed in the table. Nevada...

  2. Experimental Investigation of Compressed Thin-Walled Steel Members

    NASA Astrophysics Data System (ADS)

    Juhás, Pavol; Juhásová Šenitková, Ingrid

    2017-10-01

    The paper presents fundamental information about realized experimental-theoretical research to determinate the load-carrying capacities for thin-walled compressed steel members with quasi-homogenous and hybrid cross-sections. The webs of such members are stressed in the elastic-plastic region. This continuous research joins on previous research of the first author of the paper. The aim of this research is to investigate and analyse the elastic-plastic post-critical behaviour of thin web and its interaction with flanges. The experimental program, test members and their geometrical parameters and material properties are evident from table 1 and table 2 as well as from figure 1 and figure 2. The test arrangement and failures of the test members are illustrated on Figures 3, 4 and 5. Some partial results are presented in Table 3 of the paper, too.

  3. Flow to a well in a water-table aquifer: An improved laplace transform solution

    USGS Publications Warehouse

    Moench, A.F.

    1996-01-01

    An alternative Laplace transform solution for the problem, originally solved by Neuman, of constant discharge from a partially penetrating well in a water-table aquifer was obtained. The solution differs from existing solutions in that it is simpler in form and can be numerically inverted without the need for time-consuming numerical integration. The derivation invloves the use of the Laplace transform and a finite Fourier cosine series and avoids the Hankel transform used in prior derivations. The solution allows for water in the overlying unsaturated zone to be released either instantaneously in response to a declining water table as assumed by Neuman, or gradually as approximated by Boulton's convolution integral. Numerical evaluation yields results identical with results obtained by previously published methods with the advantage, under most well-aquifer configurations, of much reduced computation time.

  4. Tables and charts of equilibrium thermodynamic properties of ammonia for temperatures from 500 to 50,000 K.

    NASA Technical Reports Server (NTRS)

    Simmonds, A. L.; Miller, C. G., III; Nealy, J. E.

    1976-01-01

    Equilibrium thermodynamic properties for pure ammonia were generated for a range of temperature from 500 to 50,000 K and pressure from 0.01 to 40 MN/sq m and are presented in tabulated and graphical form. Properties include pressure, temperature, density, enthalpy, speed of sound, entropy, molecular-weight ratio, specific heat at constant pressure, specific heat at constant volume, isentropic exponent, and species mole fractions. These properties were calculated by the method which is based on minimization of the Gibbs free energy. The data presented herein are for an 18-species ammonia model. Heats of formation and spectroscopic constants used as input data are presented. Comparison of several thermodynamic properties calculated with the present program and a second computer code is performed for a range of pressure and for temperatures up to 30,000 K.

  5. Water exchanges versus water works: Insights from a computable general equilibrium model for the Balearic Islands

    NASA Astrophysics Data System (ADS)

    Gómez, Carlos M.; Tirado, Dolores; Rey-Maquieira, Javier

    2004-10-01

    We present a computable general equilibrium model (CGE) for the Balearic Islands, specifically performed to analyze the welfare gains associated with an improvement in the allocation of water rights through voluntary water exchanges (mainly between the agriculture and urban sectors). For the implementation of the empirical model we built the social accounting matrix (SAM) from the last available input-output table of the islands (for the year 1997). Water exchanges provide an important alternative to make the allocation of water flexible enough to cope with the cyclical droughts that characterize the natural water regime on the islands. The main conclusion is that the increased efficiency provided by ``water markets'' makes this option more advantageous than the popular alternative of building new desalinization plants. Contrary to common opinion, a ``water market'' can also have positive and significant impacts on the agricultural income.

  6. Non-axisymmetric local magnetostatic equilibrium

    DOE PAGES

    Candy, Jefferey M.; Belli, Emily A.

    2015-03-24

    In this study, we outline an approach to the problem of local equilibrium in non-axisymmetric configurations that adheres closely to Miller's original method for axisymmetric plasmas. Importantly, this method is novel in that it allows not only specification of 3D shape, but also explicit specification of the shear in the 3D shape. A spectrally-accurate method for solution of the resulting nonlinear partial differential equations is also developed. We verify the correctness of the spectral method, in the axisymmetric limit, through comparisons with an independent numerical solution. Some analytic results for the two-dimensional case are given, and the connection to Boozermore » coordinates is clarified.« less

  7. Oxygen potentials, oxygen diffusion coefficients and defect equilibria of nonstoichiometric (U,Pu)O2±x

    NASA Astrophysics Data System (ADS)

    Kato, Masato; Watanabe, Masashi; Matsumoto, Taku; Hirooka, Shun; Akashi, Masatoshi

    2017-04-01

    Oxygen potential of (U,Pu)O2±x was evaluated based on defect chemistry using an updated experimental data set. The relationship between oxygen partial pressure and deviation x in (U,Pu)O2±x was analyzed, and equilibrium constants of defect formation were determined as functions of Pu content and temperature. Brouwer's diagrams were constructed using the determined equilibrium constants, and a relational equation to determine O/M ratio was derived as functions of O/M ratio, Pu content and temperature. In addition, relationship between oxygen potential and oxygen diffusion coefficients were described.

  8. General method and thermodynamic tables for computation of equilibrium composition and temperature of chemical reactions

    NASA Technical Reports Server (NTRS)

    Huff, Vearl N; Gordon, Sanford; Morrell, Virginia E

    1951-01-01

    A rapidly convergent successive approximation process is described that simultaneously determines both composition and temperature resulting from a chemical reaction. This method is suitable for use with any set of reactants over the complete range of mixture ratios as long as the products of reaction are ideal gases. An approximate treatment of limited amounts of liquids and solids is also included. This method is particularly suited to problems having a large number of products of reaction and to problems that require determination of such properties as specific heat or velocity of sound of a dissociating mixture. The method presented is applicable to a wide variety of problems that include (1) combustion at constant pressure or volume; and (2) isentropic expansion to an assigned pressure, temperature, or Mach number. Tables of thermodynamic functions needed with this method are included for 42 substances for convenience in numerical computations.

  9. 40 CFR Table 7 to Subpart Vvvvvv... - Partially Soluble HAP

    Code of Federal Regulations, 2013 CFR

    2013-07-01

    .... Methylene chloride 75092 43. N-hexane 110543 44. N,N-dimethylaniline 121697 45. Naphthalene 91203 46...-Dichloroethylene (vinylidene chloride) 75354 5. 1,2-Dibromoethane 106934 6. 1,2-Dichloroethane (ethylene dichloride.... Acrolein 107028 15. Acrylonitrile 107131 16. Allyl chloride 107051 17. Benzene 71432 18. Benzyl chloride...

  10. 40 CFR Table 7 to Subpart Vvvvvv... - Partially Soluble HAP

    Code of Federal Regulations, 2014 CFR

    2014-07-01

    .... Methylene chloride 75092 43. N-hexane 110543 44. N,N-dimethylaniline 121697 45. Naphthalene 91203 46...-Dichloroethylene (vinylidene chloride) 75354 5. 1,2-Dibromoethane 106934 6. 1,2-Dichloroethane (ethylene dichloride.... Acrolein 107028 15. Acrylonitrile 107131 16. Allyl chloride 107051 17. Benzene 71432 18. Benzyl chloride...

  11. 40 CFR Table 7 to Subpart Vvvvvv... - Partially Soluble HAP

    Code of Federal Regulations, 2012 CFR

    2012-07-01

    .... Methylene chloride 75092 43. N-hexane 110543 44. N,N-dimethylaniline 121697 45. Naphthalene 91203 46...-Dichloroethylene (vinylidene chloride) 75354 5. 1,2-Dibromoethane 106934 6. 1,2-Dichloroethane (ethylene dichloride.... Acrolein 107028 15. Acrylonitrile 107131 16. Allyl chloride 107051 17. Benzene 71432 18. Benzyl chloride...

  12. 29 CFR 779.317 - Partial list of establishments lacking “retail concept.”

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... (such as operating instruments, X-ray machines, operating tables, etc.); establishments engaged in the... goods or facilities for the operation of such carriers (Idaho Sheet Metal Works v. Wirtz, 383 U.S. 190... distributors. Security dealers. Sheet metal contractors. Ship equipment, commercial; establishments engaged in...

  13. 29 CFR 779.317 - Partial list of establishments lacking “retail concept.”

    Code of Federal Regulations, 2010 CFR

    2010-07-01

    ... (such as operating instruments, X-ray machines, operating tables, etc.); establishments engaged in the... goods or facilities for the operation of such carriers (Idaho Sheet Metal Works v. Wirtz, 383 U.S. 190... distributors. Security dealers. Sheet metal contractors. Ship equipment, commercial; establishments engaged in...

  14. Data from: Retrospective analysis of a classical biological control programme

    USDA-ARS?s Scientific Manuscript database

    This database contains the raw data for the publication entitled Naranjo, S.E. 2018. Retrospective analysis of a classical biological control programme. Journal of Applied Ecology https://doi.org/10.1111/1365-2664.13163. Specific data include field-based, partial life table data for immature stage...

  15. A 20-year growth record for three stands of red alder.

    Treesearch

    Carl M. Berntsen

    1962-01-01

    Until very recently, only fragmentary growth information has been available for red alder (Alnus rubra). This gap has now been partially closed through the preparation of normal yield tabled based on temporary sample plot data collected in northwestern Oregon, western Washington, and southern British Columbia.

  16. Microwave Spectra of the Two Conformers of PROPENE-3-{d}_1 and a Semiexperimental Equilibrium Structure of Propene

    NASA Astrophysics Data System (ADS)

    Craig, Norman C.; Demaison, J.; Rudolph, Heinz Dieter; Gurusinghe, Ranil M.; Tubergen, Michael; Coudert, L. H.; Szalay, Peter; Császár, Attila

    2017-06-01

    FT microwave spectra have been observed and analyzed for the S (in-plane) and A (out-of-plane) conformers of propene-3-{d}_1 in the 10-22 GHz region. Both conformers display splittings due to deuterium quadrupole coupling; for the latter one only, a 19 MHz splitting due to internal rotation of the partially deuterated methyl group has been observed. In addition to rotational constants, the analysis yielded quadrupole coupling constants and parameters describing the tunneling splitting and its rotational dependence. Improved rotational constants for parent propene and the three ^{13}C_1 species are recently available. Use of vibration-rotation interaction constants computed at the MP2(FC)/cc-pVTZ level gave equilibrium rotational constants for these six species and for fourteen more deuterium isotopologues with diminished accuracy from early literature data. A semiexperimental equilibrium structure, r_e^{SE}, has been determined for propene by fitting fourteen structural parameters to the equilibrium rotational constants. The new r_e^{SE} structure compares well with an ab initio equilibrium structure computed with the all-electron CCSD(T)/cc-pV(Q,T)Z model and with a structure obtained using the mixed regression method with predicates and equilibrium rotational constants. N. C. Craig, P. Groner, A. R. Conrad, R. Gurusinghe, M. J. Tubergen J. Mol. Spectrosc. 248, 1-6 (2016).

  17. SU-G-IeP2-11: Measurement of Equilibrium Doses in Computed Tomography: Comparative Study of Ionization and Solid-State Dosimeters

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Matsubara, K; Kobayashi, A; Koshida, K

    Purpose: This study aimed to compare equilibrium doses in computed tomography (CT) obtained from ionization and solid-state dosimeters based on the approach presented in the American Association of Physicists in Medicine Report No. 111. The equilibrium doses were also compared with the CT dose index (CTDI) using a 10-cm pencil-type ionization chamber. Methods: A 0.6-cm{sup 3} ionization chamber (10X6-0.6CT) and a solid-state detector (CT Dose Profiler [CTDP]) were calibrated using 80–130 kVp X-ray beams (44.5–55.8 keV of effective energy) from a radiography X-ray machine against a reference ionization dosimeter. Three 16- or 32-cm diameter polymethyl methacrylate (PMMA) phantoms were assembledmore » consecutively on the CT table to obtain equilibrium doses. The 10X6-0.6CT and CTDP were each placed at the center and peripheral holes (12, 3, 6, and 9 o’clock) of the z-center. Central and mean peripheral equilibrium doses were obtained by scanning with longitudinal translation for a length less than the entire phantom length. CTDIs were also obtained with a 10-cm pencil-type ionization chamber (10X6-0.6CT) by scanning a 16- or 32-cm diameter PMMA phantom with one rotation of the X-ray tube. Results: The difference of calibration coefficients between 80 and 130 kVp was 21.1% for the CTDP and 0.7% for the 10X6-0.6CT. The equilibrium doses were higher than the CTDI. Especially at the peripheral positions and 80 kVp, the 10X6-0.6CT showed higher equilibrium doses than CTDP. However, the relation between the equilibrium dose for the 10X6-0.6CT and the CTDP differed depending on the phantom size, scanner type, measurement position, and selected acquisition parameters. Conclusion: The use of a 10-cm pencil-type ionization chamber causes underestimation of the equilibrium dose. The CTDP has a higher energy dependency than the 10X6-0.6CT. The obtained equilibrium doses are different between the 10X6-0.6CT and the CTDP depending on various conditions. This study was supported by JSPS KAKENHI Grant Number 15K09887.« less

  18. Excited atoms in the free-burning Ar arc: treatment of the resonance radiation

    NASA Astrophysics Data System (ADS)

    Golubovskii, Yu; Kalanov, D.; Gortschakow, S.; Baeva, M.; Uhrlandt, D.

    2016-11-01

    The collisional-radiative model with an emphasis on the accurate treatment of the resonance radiation transport is developed and applied to the free-burning Ar arc plasma. This model allows for analysis of the influence of resonance radiation on the spatial density profiles of the atoms in different excited states. The comparison of the radial density profiles obtained using an effective transition probability approximation with the results of the accurate solution demonstrates the distinct impact of transport on the profiles and absolute densities of the excited atoms, especially in the arc fringes. The departures from the Saha-Boltzmann equilibrium distributions, caused by different radiative transitions, are analyzed. For the case of the DC arc, the local thermodynamic equilibrium (LTE) state holds close to the arc axis, while strong deviations from the equilibrium state on the periphery occur. In the intermediate radial positions the conditions of partial LTE are fulfilled.

  19. Aerothermodynamic radiation studies

    NASA Technical Reports Server (NTRS)

    Donohue, K.; Reinecke, W. G.; Rossi, D.; Marinelli, W. J.; Krech, R. H.; Caledonia, G. E.

    1991-01-01

    We have built and made operational a 6 in. electric arc driven shock tube which alloys us to study the non-equilibrium radiation and kinetics of low pressure (0.1 to 1 torr) gases processed by 6 to 12 km/s shock waves. The diagnostic system allows simultaneous monitoring of shock radiation temporal histories by a bank of up to six radiometers, and spectral histories with two optical multi-channel analyzers. A data set of eight shots was assembled, comprising shocks in N2 and air at pressures between 0.1 and 1 torr and velocities of 6 to 12 km/s. Spectrally resolved data was taken in both the non-equilibrium and equilibrium shock regions on all shots. The present data appear to be the first spectrally resolved shock radiation measurements in N2 performed at 12 km/s. The data base was partially analyzed with salient features identified.

  20. Preparing highly ordered glasses of discotic liquid crystalline systems by vapor deposition

    NASA Astrophysics Data System (ADS)

    Gujral, Ankit; Gomez, Jaritza; Bishop, Camille E.; Toney, Michael F.; Ediger, M. D.

    Anisotropic molecular packing, particularly in highly ordered liquid-crystalline arrangements, has the potential for optimizing performance in organic electronic and optoelectronic applications. Here we show that physical vapor deposition can be used to prepare highly organized out-of-equilibrium (glassy) solids of discotic liquid-crystalline (LC) systems. Using grazing incidence x-ray scattering, we compare 3 systems: a rectangular columnar LC, a hexagonal columnar LC and a non-liquid crystal former. The packing motifs accessible by vapor deposition are highly organized and vary from face-on to edge-on columnar arrangements depending upon substrate temperature. A subset of these structures cannot be accessed under equilibrium conditions. The structures formed at a given substrate temperature can be understood as the result of the system partially equilibrating toward the structure of the free surface of the equilibrium liquid crystal. Consistent with this view, the structures formed are independent of the substrate material.

  1. The intrinsic role of nanoconfinement in chemical equilibrium: evidence from DNA hybridization.

    PubMed

    Rubinovich, Leonid; Polak, Micha

    2013-05-08

    Recently we predicted that when a reaction involving a small number of molecules occurs in a nanometric-scale domain entirely segregated from the surrounding media, the nanoconfinement can shift the position of equilibrium toward products via reactant-product reduced mixing. In this Letter, we demonstrate how most-recently reported single-molecule fluorescence measurements of partial hybridization of ssDNA confined within nanofabricated chambers provide the first experimental confirmation of this entropic nanoconfinement effect. Thus, focusing separately on each occupancy-specific equilibrium constant, quantitatively reveals extra stabilization of the product upon decreasing the chamber occupancy or size. Namely, the DNA hybridization under nanoconfined conditions is significantly favored over the identical reaction occurring in bulk media with the same reactant concentrations. This effect, now directly verified for DNA, can be relevant to actual biological processes, as well as to diverse reactions occurring within molecular capsules, nanotubes, and other functional nanospaces.

  2. Gas-phase measurements of combustion interaction with materials for radiation-cooled chambers

    NASA Technical Reports Server (NTRS)

    Barlow, R. S.; Lucht, R. P.; Jassowski, D. M.; Rosenberg, S. D.

    1991-01-01

    Foil samples of Ir and Pt are exposed to combustion products in a controlled premixed environment at atmospheric pressure. Electrical heating of the foil samples is used to control the surface temperature and to elevate it above the radiative equilibrium temperature within the test apparatus. Profiles of temperature and OH concentration in the boundary layer adjacent to the specimen surface are measured by laser-induced fluorescence. Measured OH concentrations are significantly higher than equilibrium concentrations calculated for the known mixture ratio and the measured temperature profiles. This result indicates that superequilibrium concentrations of H-atoms and O-atoms are also present in the boundary layer, due to partial equilibrium of the rapid binary reactions of the H2/O2 chemical kinetic system. These experiments are conducted as part of a research program to investigate fundamental aspects of the interaction of combustion gases with advanced high-temperature materials for radiation-cooled thrusters.

  3. Mechanism of α-ketol-type rearrangement of benzoin derivatives under basic conditions.

    PubMed

    Karino, Masahiro; Kubouchi, Daiki; Hamaoka, Kazuki; Umeyama, Shintaro; Yamataka, Hiroshi

    2013-07-19

    The mechanism of base-catalyzed rearrangement of ring-substituted benzoins in aqueous methanol was examined by kinetic and product analyses. Substituent effects on the rate and equilibrium constants revealed that the kinetic process has a different electron demand compared to the equilibrium process. Reactions in deuterated solvents showed that the rate of H/D exchange of the α-hydrogen is similar to the overall rate toward the equilibrium state. A proton-inventory experiment using partially deuterated solvents showed a linear dependence of the rate on the deuterium fraction of the solvent, indicating that only one deuterium isotope effect contributes to the overall rate process. All these results point to a mechanism in which the rearrangement is initiated by the rate-determining α-hydrogen abstraction rather than a mechanism with initial hydroxyl hydrogen abstraction as in the general α-ketol rearrangement.

  4. L4 Milestone Report for MixEOS 2016 experiments and simulations

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Loomis, Eric Nicholas; Bradley, Paul Andrew; Merritt, Elizabeth Catherine

    2016-08-01

    Accurate simulations of fluid and plasma flows require accurate thermodynamic properties of the fluids or plasmas. This thermodynamic information is represented by the equations of state of the materials. For pure materials, the equations of state may be represented by analytical models for idealized circumstances, or by tabular means, such as the Sesame tables. However, when a computational cell has a mixture of two or more fluids, the equations of state are not well understood, particularly under the circumstances of high energy densities. This is a particularly difficult issue for Eulerian codes, wherein mixed cells arise simply due to themore » advection process. LANL Eulerian codes typically assume an “Amagat’s Law” (or Law of Partial Volumes) for the mixture in which the pressures and temperatures of fluids are at an equilibrium that is consistent with the fluids being segregated within the cell. However, for purposes of computing other EOS properties, e.g., bulk modulus, or sound speed, the fluids are considered to be fully “mixed”. LANL has also been investigating implementing instead “Dalton’s Law” in which the total pressure is considered to be the sum of the partial pressures within the cell. For ideal gases, these two laws give the same result. Other possibilities are nonpressure- temperature-equilibrated approaches in which the two fluids are not assumed to “mix” at all, and the EOS properties of the cell are computed from, say, volume-weighted averages of the individual fluid properties. The assumption of the EOS properties within a mixed cell can have a pronounced effect on the behavior of the cell, resulting in, for example, different shock speeds, pressures, temperatures and densities within the cell. There is no apparent consensus as to which approach is best under HED conditions, though we note that under typical atmospheric and near atmospheric conditions the differences may be slight.« less

  5. Thermodynamic Properties of Nitrogen Including Liquid and Vapor Phases from 63K to 2000K with Pressures to 10,000 Bar

    NASA Technical Reports Server (NTRS)

    Jacobsen, Richard T.; Stewart, Richard B.

    1973-01-01

    Tables of thermodynamic properties of nitrogen are presented for the liquid and vapor phases for temperatures from the freezing line to 2000K and pressures to 10,000 bar. The tables include values of density, internal energy, enthalpy, entropy, isochoric heat capacity, isobaric heat capacity velocity of sound, the isotherm derivative, and the isochor derivative. The thermodynamic property tables are based on an equation of state, P=P (p,T), which accurately represents liquid and gaseous nitrogen for the range of pressures and temperatures covered by the tables. Comparisons of property values calculated from the equation of state with measured values for P-p-T, heat capacity, enthalpy, latent heat, and velocity of sound are included to illustrate the agreement between the experimental data and the tables of properties presented here. The coefficients of the equation of state were determined by a weighted least squares fit to selected P-p-T data and, simultaneously, to isochoric heat capacity data determined by corresponding states analysis from oxygen data, and to data which define the phase equilibrium criteria for the saturated liquid and the saturated vapor. The vapor pressure equation, melting curve equation, and an equation to represent the ideal gas heat capacity are also presented. Estimates of the accuracy of the equation of state, the vapor pressure equation, and the ideal gas heat capacity equation are given. The equation of state, derivatives of the equation, and the integral functions for calculating derived thermodynamic properties are included.

  6. Lookup Tables Versus Stacked Rasch Analysis in Comparing Pre- and Postintervention Adult Strabismus-20 Data.

    PubMed

    Leske, David A; Hatt, Sarah R; Liebermann, Laura; Holmes, Jonathan M

    2016-02-01

    We compare two methods of analysis for Rasch scoring pre- to postintervention data: Rasch lookup table versus de novo stacked Rasch analysis using the Adult Strabismus-20 (AS-20). One hundred forty-seven subjects completed the AS-20 questionnaire prior to surgery and 6 weeks postoperatively. Subjects were classified 6 weeks postoperatively as "success," "partial success," or "failure" based on angle and diplopia status. Postoperative change in AS-20 scores was compared for all four AS-20 domains (self-perception, interactions, reading function, and general function) overall and by success status using two methods: (1) applying historical Rasch threshold measures from lookup tables and (2) performing a stacked de novo Rasch analysis. Change was assessed by analyzing effect size, improvement exceeding 95% limits of agreement (LOA), and score distributions. Effect sizes were similar for all AS-20 domains whether obtained from lookup tables or stacked analysis. Similar proportions exceeded 95% LOAs using lookup tables versus stacked analysis. Improvement in median score was observed for all AS-20 domains using lookup tables and stacked analysis ( P < 0.0001 for all comparisons). The Rasch-scored AS-20 is a responsive and valid instrument designed to measure strabismus-specific health-related quality of life. When analyzing pre- to postoperative change in AS-20 scores, Rasch lookup tables and de novo stacked Rasch analysis yield essentially the same results. We describe a practical application of lookup tables, allowing the clinician or researcher to score the Rasch-calibrated AS-20 questionnaire without specialized software.

  7. Lookup Tables Versus Stacked Rasch Analysis in Comparing Pre- and Postintervention Adult Strabismus-20 Data

    PubMed Central

    Leske, David A.; Hatt, Sarah R.; Liebermann, Laura; Holmes, Jonathan M.

    2016-01-01

    Purpose We compare two methods of analysis for Rasch scoring pre- to postintervention data: Rasch lookup table versus de novo stacked Rasch analysis using the Adult Strabismus-20 (AS-20). Methods One hundred forty-seven subjects completed the AS-20 questionnaire prior to surgery and 6 weeks postoperatively. Subjects were classified 6 weeks postoperatively as “success,” “partial success,” or “failure” based on angle and diplopia status. Postoperative change in AS-20 scores was compared for all four AS-20 domains (self-perception, interactions, reading function, and general function) overall and by success status using two methods: (1) applying historical Rasch threshold measures from lookup tables and (2) performing a stacked de novo Rasch analysis. Change was assessed by analyzing effect size, improvement exceeding 95% limits of agreement (LOA), and score distributions. Results Effect sizes were similar for all AS-20 domains whether obtained from lookup tables or stacked analysis. Similar proportions exceeded 95% LOAs using lookup tables versus stacked analysis. Improvement in median score was observed for all AS-20 domains using lookup tables and stacked analysis (P < 0.0001 for all comparisons). Conclusions The Rasch-scored AS-20 is a responsive and valid instrument designed to measure strabismus-specific health-related quality of life. When analyzing pre- to postoperative change in AS-20 scores, Rasch lookup tables and de novo stacked Rasch analysis yield essentially the same results. Translational Relevance We describe a practical application of lookup tables, allowing the clinician or researcher to score the Rasch-calibrated AS-20 questionnaire without specialized software. PMID:26933524

  8. Poro-mechanical coupling influences on potential for rainfall-induced shallow landslides in unsaturated soils

    NASA Astrophysics Data System (ADS)

    Wu, L. Z.; Selvadurai, A. P. S.; Zhang, L. M.; Huang, R. Q.; Huang, Jinsong

    2016-12-01

    Rainfall-induced landslides are a common occurrence in terrain with steep topography and soils that have degradable strength. Rainfall infiltration into a partially saturated slope of infinite extent can lead to either a decrease or complete elimination of soil suction, compromising the slopes' stability. In this research the rainfall infiltration coupled with deformation of a partially saturated soil slope during rainfall infiltration is analyzed. The limit equilibrium conditions and the shear strength relationship of a partially saturated soil are employed to develop an analytical solution for calculating the stability of an infinite partially saturated slope due to rainfall infiltration. The analytical solutions are able to consider the influence of the coupled effects on the stability of the slope. The factors that affect the safety of a partially saturated slope of infinite extent are discussed. The results indicate that the poro-mechanical coupling of water infiltration and deformation has an important effect on the stability of the infinite unsaturated slope.

  9. Hydrostatic Paradox: Experimental Verification of Pressure Equilibrium

    ERIC Educational Resources Information Center

    Kodejška, C.; Ganci, S.; Ríha, J.; Sedlácková, H.

    2017-01-01

    This work is focused on the experimental verification of the balance between the atmospheric pressure acting on the sheet of paper, which encloses the cylinder completely or partially filled with water from below, where the hydrostatic pressure of the water column acts against the atmospheric pressure. First of all this paper solves a theoretical…

  10. An Introduction to Equilibrium Thermodynamics: A Rational Approach to Its Teaching. Part 1: Notation and Mathematics.

    ERIC Educational Resources Information Center

    Williams, Donald F.; Glasser, David

    1991-01-01

    Introduces and develops mathematical notation to assist undergraduate students in overcoming conceptual difficulties involving the underlying mathematics of state functions, which tend to be different from functions encountered by students in previous mathematical courses, because of the need to manipulate special types of partial derivatives and…

  11. Use of sunlight to partially detoxify groundnut (peanut) cake flour and casein contaminated with aflatoxin B1.

    PubMed

    Shantha, T; Murthy, V S

    1981-03-01

    Sunlight destroyed 83 and 50% of the toxin added to casein and groundnut cake flour, respectively. Equilibrium dialysis revealed that both casein and groundnut protein bind aflatoxin but the toxin bound to casein appeared more photo-labile than that bound to groundnut protein.

  12. A moving mesh finite difference method for equilibrium radiation diffusion equations

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Yang, Xiaobo, E-mail: xwindyb@126.com; Huang, Weizhang, E-mail: whuang@ku.edu; Qiu, Jianxian, E-mail: jxqiu@xmu.edu.cn

    2015-10-01

    An efficient moving mesh finite difference method is developed for the numerical solution of equilibrium radiation diffusion equations in two dimensions. The method is based on the moving mesh partial differential equation approach and moves the mesh continuously in time using a system of meshing partial differential equations. The mesh adaptation is controlled through a Hessian-based monitor function and the so-called equidistribution and alignment principles. Several challenging issues in the numerical solution are addressed. Particularly, the radiation diffusion coefficient depends on the energy density highly nonlinearly. This nonlinearity is treated using a predictor–corrector and lagged diffusion strategy. Moreover, the nonnegativitymore » of the energy density is maintained using a cutoff method which has been known in literature to retain the accuracy and convergence order of finite difference approximation for parabolic equations. Numerical examples with multi-material, multiple spot concentration situations are presented. Numerical results show that the method works well for radiation diffusion equations and can produce numerical solutions of good accuracy. It is also shown that a two-level mesh movement strategy can significantly improve the efficiency of the computation.« less

  13. Performance of hashed cache data migration schemes on multicomputers

    NASA Technical Reports Server (NTRS)

    Hiranandani, Seema; Saltz, Joel; Mehrotra, Piyush; Berryman, Harry

    1991-01-01

    After conducting an examination of several data-migration mechanisms which permit an explicit and controlled mapping of data to memory, a set of schemes for storage and retrieval of off-processor array elements is experimentally evaluated and modeled. All schemes considered have their basis in the use of hash tables for efficient access of nonlocal data. The techniques in question are those of hashed cache, partial enumeration, and full enumeration; in these, nonlocal data are stored in hash tables, so that the operative difference lies in the amount of memory used by each scheme and in the retrieval mechanism used for nonlocal data.

  14. Melt-Vapor Phase Diagram of the Te-S System

    NASA Astrophysics Data System (ADS)

    Volodin, V. N.; Trebukhov, S. A.; Kenzhaliyev, B. K.; Nitsenko, A. V.; Burabaeva, N. M.

    2018-03-01

    The values of partial pressure of saturated vapor of the constituents of the Te-S system are determined from boiling points. The boundaries of the melt-vapor phase transition at atmospheric pressure and in vacuum of 2000 and 100 Pa are calculated on the basis of partial pressures. A phase diagram that includes vapor-liquid equilibrium fields whose boundaries allow us to assess the behavior of elements upon distillation fractioning is plotted. It is established that the separation of elements is possible at the first evaporation-condensation cycle. Complications can be caused by crystallization of a sulfur solid solution in tellurium.

  15. Index of surface-water stations in Texas, January 1986

    USGS Publications Warehouse

    Carrillo, E.R.; Buckner, H.D.; Rawson, Jack

    1986-01-01

    As of January 1, 1986, the surface-water data-collection network in Texas operated by the U.S. Geological Survey included 386 streamflow, 87 reservoir-contents, 33 stage, 10 crest-stage partial-record, 8 periodic discharge through range, 38 flood-hydrograph partial-record, 11 flood-profile partial-record , 36 low-flow partial-record 2 tide-level, 45 daily chemical-quality, 23 continuous-recording water-quality, 97 periodic biological, 19 lake surveys, 174 periodic organic- and (or) nutrient, 4 periodic insecticide, 58 periodic pesticide, 22 automatic sampler, 157 periodic minor elements, 141 periodic chemical-quality, 108 periodic physical-organic, 14 continuous-recording three- or four-parameter water-quality, 3 sediment, 39 periodic sediment, 26 continuous-recording temperature, and 37 national stream-quality accounting network stations were in operation. Tables describing the station location, type of data collected, and place where data are available are included, as well as maps showing the location of most of the stations. (USGS)

  16. Landsliding in partially saturated materials

    USGS Publications Warehouse

    Godt, J.W.; Baum, R.L.; Lu, N.

    2009-01-01

    [1] Rainfall-induced landslides are pervasive in hillslope environments around the world and among the most costly and deadly natural hazards. However, capturing their occurrence with scientific instrumentation in a natural setting is extremely rare. The prevailing thinking on landslide initiation, particularly for those landslides that occur under intense precipitation, is that the failure surface is saturated and has positive pore-water pressures acting on it. Most analytic methods used for landslide hazard assessment are based on the above perception and assume that the failure surface is located beneath a water table. By monitoring the pore water and soil suction response to rainfall, we observed shallow landslide occurrence under partially saturated conditions for the first time in a natural setting. We show that the partially saturated shallow landslide at this site is predictable using measured soil suction and water content and a novel unified effective stress concept for partially saturated earth materials. Copyright 2009 by the American Geophysical Union.

  17. 75 FR 47488 - FM Table of Allotments, Boulder Town, Levan, Mount Pleasant, and Richfield, UT

    Federal Register 2010, 2011, 2012, 2013, 2014

    2010-08-06

    ... reconsideration, denied. SUMMARY: The Audio Division grants a Petition for Partial Reconsideration filed by... KLGL(FM) from Richfield to Mount Pleasant, Utah. The Audio Division also denies a Petition for... Commission. John A. Karousos, Assistant Chief, Audio Division Media Bureau. [FR Doc. 2010-19456 Filed 8-5-10...

  18. 77 FR 34326 - Medicare Program; Hospital Inpatient Prospective Payment Systems for Acute Care Hospitals and the...

    Federal Register 2010, 2011, 2012, 2013, 2014

    2012-06-11

    ... Purchasing (VBP) Program, we inadvertently omitted data from the table entitled ``Proposed Performance..., Proposed Hospital Inpatient Value- Based Purchasing (VBP) Program Adjustment Factors for FY 2013, as a... partial paragraph-- (1) Lines 2 and 3, the phrase ``all hospitals are expected to experience a decrease...

  19. Evaluation of Room-Temperature Chloroaluminate Molten Salts as Electrolytes for High Energy Density Batteries

    DTIC Science & Technology

    1990-04-01

    is its conjugate base. This equilibrium is analogous to the autoionisation of water : 2HO 4= HsO+ + OH- Compositions of N < 0.50 are said to be basic...0.66 10.1 water 0.8903 glycerol 942 TABLE II. Kinematic viscosities at 25°C for MEIC-AICII melts at various compositions. 7 Water and glycerol are...drybox with a circulating helium atmosphere maintained at loes than 15 ppm total oxygen and water content. Reagents 10 were ued as received. Gas

  20. Arsenic Contaminated Groundwater Treatment Pilot Study at the Sharpe Army Depot (SHAD) Lathrop, California. Task Order 9

    DTIC Science & Technology

    1990-12-01

    I- I IIIIII 11HI ca~ 1- 1.cc III I HHo I H [I I 5-12 December 1990 Revision: 1 in Table 5-6, the performance of F-1 AA, in terms of the equilibrium...required. In treatment of water for boiler makeup, the relative freedom of Amberlite I RA-402 from *. ..IOEAIGCHRCEITC organic fouling insures good...hydroxide form) 1400 F (600 C) medium pressure boilers . This represents a considerable f chloride form) 1700 F (77 0C) saving over the use of deionization

  1. Temporal Evolution of Non-equilibrium Gamma’ Precipitates in a Rapidly Quenched Nickel Base Superalloy (Preprint)

    DTIC Science & Technology

    2014-04-01

    with the binomial distribution for a particular dataset. This technique is more commonly known as the Langer, Bar-on and Miller ( LBM ) method [22,23...distribution unlimited. Using the LBM method, the frequency distribution plot for a dataset corresponding to a phase separated system, exhibiting a split peak...estimated parameters (namely μ1, μ2, σ, fγ’ and fγ) obtained from the LBM plots in Fig. 5 are summarized in Table 3. The EWQ sample does not exhibit any

  2. Population kinetics on K alpha lines of partially ionized Cl atoms.

    PubMed

    Kawamura, Tohru; Nishimura, Hiroaki; Koike, Fumihiro; Ochi, Yoshihiro; Matsui, Ryoji; Miao, Wen Yong; Okihara, Shinichiro; Sakabe, Shuji; Uschmann, Ingo; Förster, Eckhart; Mima, Kunioki

    2002-07-01

    A population kinetics code was developed to analyze K alpha emission from partially ionized chlorine atoms in hydrocarbon plasmas. Atomic processes are solved under collisional-radiative equilibrium for two-temperature plasmas. It is shown that the fast electrons dominantly contribute to ionize the K-shell bound electrons (i.e., inner-shell ionization) and the cold electrons to the outer-shell bound ones. Ratios of K alpha lines of partially ionized atoms are presented as a function of cold-electron temperature. The model was validated by observation of the K alpha lines from a chlorinated plastic target irradiated with 1 TW Ti:sapphire laser pulses at 1.5 x 10(17) W/cm(2), inferring a plasma temperature of about 100 eV on the target surface.

  3. Dynamical Analysis of an SEIT Epidemic Model with Application to Ebola Virus Transmission in Guinea.

    PubMed

    Li, Zhiming; Teng, Zhidong; Feng, Xiaomei; Li, Yingke; Zhang, Huiguo

    2015-01-01

    In order to investigate the transmission mechanism of the infectious individual with Ebola virus, we establish an SEIT (susceptible, exposed in the latent period, infectious, and treated/recovery) epidemic model. The basic reproduction number is defined. The mathematical analysis on the existence and stability of the disease-free equilibrium and endemic equilibrium is given. As the applications of the model, we use the recognized infectious and death cases in Guinea to estimate parameters of the model by the least square method. With suitable parameter values, we obtain the estimated value of the basic reproduction number and analyze the sensitivity and uncertainty property by partial rank correlation coefficients.

  4. 1H NMR investigation of thermally triggered insulin release from poly(N-isopropylacrylamide) microgels.

    PubMed

    Nolan, Christine M; Gelbaum, Leslie T; Lyon, L Andrew

    2006-10-01

    We describe investigations of insulin release from thermoresponsive microgels using variable temperature (1)H NMR. Microgel particles composed of poly(N-isopropylacrylamide) were loaded with the peptide via a swelling technique, and this method was compared to simple equilibrium partitioning. Variable temperature (1)H NMR studies suggest that the swelling loading method results in enhanced entrapment of the peptide versus equilibrium partitioning. A centrifugation-loading assay supports this finding. Pseudo-temperature jump (1)H NMR measurements suggest that the insulin release rate is partially decoupled from microgel collapse. These types of direct release investigations could prove to be useful methods in the future design of controlled macromolecule drug delivery devices.

  5. A staging table for the embryonic development of the brownbanded bamboo shark (Chiloscyllium punctatum)

    PubMed Central

    Onimaru, Koh; Motone, Fumio; Kiyatake, Itsuki; Nishida, Kiyonori

    2018-01-01

    Background: Studying cartilaginous fishes (chondrichthyans) has helped us understand vertebrate evolution and diversity. However, resources such as genome sequences, embryos, and detailed staging tables are limited for species within this clade. To overcome these limitations, we have focused on a species, the brownbanded bamboo shark (Chiloscyllium punctatum), which is a relatively common aquarium species that lays eggs continuously throughout the year. In addition, because of its relatively small genome size, this species is promising for molecular studies. Results: To enhance biological studies of cartilaginous fishes, we establish a normal staging table for the embryonic development of the brownbanded bamboo shark. Bamboo shark embryos take around 118 days to reach the hatching period at 25°C, which is approximately 1.5 times as fast as the small‐spotted catshark (Scyliorhinus canicula) takes. Our staging table divides the embryonic period into 38 stages. Furthermore, we found culture conditions that allow early embryos to grow in partially opened egg cases. Conclusions: In addition to the embryonic staging table, we show that bamboo shark embryos exhibit relatively fast embryonic growth and are amenable to culture, key characteristics that enhance their experimental utility. Therefore, the present study is a foundation for cartilaginous fish research. Developmental Dynamics 247:712–723, 2018. © 2017 Wiley Periodicals, Inc. PMID:29396887

  6. Interaction of Aquifer and River-Canal Network near Well Field.

    PubMed

    Ghosh, Narayan C; Mishra, Govinda C; Sandhu, Cornelius S S; Grischek, Thomas; Singh, Vikrant V

    2015-01-01

    The article presents semi-analytical mathematical models to asses (1) enhancements of seepage from a canal and (2) induced flow from a partially penetrating river in an unconfined aquifer consequent to groundwater withdrawal in a well field in the vicinity of the river and canal. The nonlinear exponential relation between seepage from a canal reach and hydraulic head in the aquifer beneath the canal reach is used for quantifying seepage from the canal reach. Hantush's (1967) basic solution for water table rise due to recharge from a rectangular spreading basin in absence of pumping well is used for generating unit pulse response function coefficients for water table rise in the aquifer. Duhamel's convolution theory and method of superposition are applied to obtain water table position due to pumping and recharge from different canal reaches. Hunt's (1999) basic solution for river depletion due to constant pumping from a well in the vicinity of a partially penetrating river is used to generate unit pulse response function coefficients. Applying convolution technique and superposition, treating the recharge from canal reaches as recharge through conceptual injection wells, river depletion consequent to variable pumping and recharge is quantified. The integrated model is applied to a case study in Haridwar (India). The well field consists of 22 pumping wells located in the vicinity of a perennial river and a canal network. The river bank filtrate portion consequent to pumping is quantified. © 2014, National GroundWater Association.

  7. History versus Equilibrium Revisited: Rethinking Neoclassical Economics as the Foundation of Business Education

    ERIC Educational Resources Information Center

    Clark, Charles Michael Andres

    2014-01-01

    The financial crisis was partially caused by neoclassical economic theory and theorists. This failure has prompted business educators to rethink the role of neoclassical economics as the foundation of business education. The author connects this question to the more general critique of the scientific model of business education and the old…

  8. Impacts of the Jones Act on the Alaska forest products trade.

    Treesearch

    K.C. Jackson; C.W. McKetta

    1986-01-01

    Alaska forest products trade flows for 1982 were studied to determine the effects of the Merchant Marine Act of 1920 (the Jones Act). Information was collected from timber producers, forest product industries, and waterborne shippers in Alaska, British Columbia, and the Pacific Northwest. Trade flows were simulated, using a partial equilibrium model based on resource...

  9. A new device for continuous monitoring the CO2 dissolved in water

    NASA Astrophysics Data System (ADS)

    de Gregorio, S.; Camarda, M.; Cappuzzo, S.; Giudice, G.; Gurrieri, S.; Longo, M.

    2009-04-01

    The measurements of dissolved CO2 in water are common elements of industrial processes and scientific research. In order to perform gas dissolved measurements is required to separate the dissolved gaseous phase from water. We developed a new device able to separate the gases phase directly in situ and well suitable for continuous measuring the CO2 dissolved in water. The device is made by a probe of a polytetrafluorethylene (PTFE) tube connected to an I.R. spectrophotometer (I.R.) and a pump. The PTFE is a polymeric semi-permeable membrane and allows the permeation of gas in the system. Hence, this part of the device is dipped in water in order to equilibrate the probe headspace with the dissolved gases. The partial pressure of the gas i in the headspace at equilibrium (Pi) follows the Henry's law: Pi=Hi•Ci, where Hi is the Henry's constant and Ci is the dissolved concentration of gas i. After the equilibrium is achieved, the partial pressure of CO2 inside the tube is equal to the partial pressure of dissolved CO2. The concentration of CO2 is measured by the I.R. connected to the tube. The gas is moved from the tube headspace to the I.R. by using the pump. In order to test the device and assess the best operating condition, several experimental were performed in laboratory. All the test were executed in a special apparatus where was feasible to create controlled atmospheres. Afterward the device has been placed in a draining tunnel sited in the Mt. Etna Volcano edifice (Italy). The monitored groundwater intercepts the Pernicana Fault, along which degassing phenomena are often observed. The values recorded by the station result in agreement with monthly directly measurements of dissolved CO2 partial pressure.

  10. Secondary precious metal enrichment by steam-heated fluids in the Crofoot-Lewis hot spring gold-silver deposit and relation to paleoclimate

    USGS Publications Warehouse

    Ebert, S.W.; Rye, R.O.

    1997-01-01

    The Crofoot-Lewis deposit is an adularia-sericite-type (low-sulfidation) epithermal Au-Ag deposit, whose well-preserved paleosurface includes abundant opaline sinters, widespread and intense silicification, bedded hydrothermal eruption breccias, and a large zone of acid sulfate alteration. Radiogenic isotope ages indicate that the system was relatively long-lived, with hydrothermal activity starting around 4 Ma and extending, at least intermittently, for the next 3 m.y. Field evidence indicates that the surficial zone of acid sulfate alteration formed in a steam-heated environment within an active geothermal system. A drop in the water table enabled descending acid sulfate waters to leach Au and Ag from zones of low-grade disseminated mineralization, resulting in the redistribution and concentration of Au and Ag into ore-grade concentrations. These zones of secondary Au-Ag enrichment are associated with opal + alunite + kaolinite + montmorillonite ?? hematite and were deposited in open space fractures at, and within a few tens of meters below, the paleowater table. The stable isotope systematics of alunite and kaolinite in the steam-heated environment are relatively complex, due to variations in the residence time of aqueous SO4 that formed from the oxidation of H2S prior to precipitation of alunite, and the susceptibility of fine-grained kaolinites to hydrogen isotope exchange with later waters. Most of the alunites are enriched in 34S relative to early sulfide minerals, reflecting partial S isotope exchange between aqueous SO4 and H2S. About half of the alunites give reasonable calculated ??18OSO4-OH temperatures for a steam-heated environment indicating O isotope equilibrium between aqueous SO4 and water. The ??5DH2O values of the hydrothermal fluids varied by almost 60 per mil over the life of the meteoric water-dominated system, suggesting significant climate changes. Mineralization is believed to have resulted from large-scale convection of meteoric water controlled largely by basin and range fractures and a high geothermal gradient with H2S for Au complexing derived from organic matter in basin sediments. A wet climate resulted in the formation of a large inland lake which provided abundant recharge water for the hydrothermal system. A fluctuating water table controlled by changing climatic conditions enabled steam-heated acid sulfate fluids to overprint lower grade mineralization resulting in ore-grade precious metal enrichment.

  11. NEW HYPERON EQUATIONS OF STATE FOR SUPERNOVAE AND NEUTRON STARS IN DENSITY-DEPENDENT HADRON FIELD THEORY

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Banik, Sarmistha; Hempel, Matthias; Bandyopadhyay, Debades

    2014-10-01

    We develop new hyperon equation of state (EoS) tables for core-collapse supernova simulations and neutron stars. These EoS tables are based on a density-dependent relativistic hadron field theory where baryon-baryon interaction is mediated by mesons, using the parameter set DD2 for nucleons. Furthermore, light and heavy nuclei along with interacting nucleons are treated in the nuclear statistical equilibrium model of Hempel and Schaffner-Bielich which includes excluded volume effects. Of all possible hyperons, we consider only the contribution of Λs. We have developed two variants of hyperonic EoS tables: in the npΛφ case the repulsive hyperon-hyperon interaction mediated by the strangemore » φ meson is taken into account, and in the npΛ case it is not. The EoS tables for the two cases encompass a wide range of densities (10{sup –12} to ∼1 fm{sup –3}), temperatures (0.1 to 158.48 MeV), and proton fractions (0.01 to 0.60). The effects of Λ hyperons on thermodynamic quantities such as free energy per baryon, pressure, or entropy per baryon are investigated and found to be significant at higher densities. The cold, β-equilibrated EoS (with the crust included self-consistently) results in a 2.1 M {sub ☉} maximum mass neutron star for the npΛφ case, whereas that for the npΛ case is 1.95 M {sub ☉}. The npΛφ EoS represents the first supernova EoS table involving hyperons that is directly compatible with the recently measured 2 M {sub ☉} neutron stars.« less

  12. Partial slip effect in the flow of MHD micropolar nanofluid flow due to a rotating disk - A numerical approach

    NASA Astrophysics Data System (ADS)

    Ramzan, Muhammad; Chung, Jae Dong; Ullah, Naeem

    The aim of present exploration is to study the flow of micropolar nanofluid due to a rotating disk in the presence of magnetic field and partial slip condition. The governing coupled partial differential equations are reduced to nonlinear ordinary differential equations using appropriate transformations. The differential equations are solved numerically by using Maple dsolve command with option numeric which utilize Runge-Kutta fourth-fifth order Fehlberg technique. A comparison to previous study is also added to validate the present results. Moreover, behavior of different parameters on velocity, microrotation, temperature and concentration of nanofluid are presented via graphs and tables. It is noted that the slip effect and magnetic field decay the velocity and microrotation or spin component.

  13. A novel multiphysic model for simulation of swelling equilibrium of ionized thermal-stimulus responsive hydrogels

    NASA Astrophysics Data System (ADS)

    Li, Hua; Wang, Xiaogui; Yan, Guoping; Lam, K. Y.; Cheng, Sixue; Zou, Tao; Zhuo, Renxi

    2005-03-01

    In this paper, a novel multiphysic mathematical model is developed for simulation of swelling equilibrium of ionized temperature sensitive hydrogels with the volume phase transition, and it is termed the multi-effect-coupling thermal-stimulus (MECtherm) model. This model consists of the steady-state Nernst-Planck equation, Poisson equation and swelling equilibrium governing equation based on the Flory's mean field theory, in which two types of polymer-solvent interaction parameters, as the functions of temperature and polymer-network volume fraction, are specified with or without consideration of the hydrogen bond interaction. In order to examine the MECtherm model consisting of nonlinear partial differential equations, a meshless Hermite-Cloud method is used for numerical solution of one-dimensional swelling equilibrium of thermal-stimulus responsive hydrogels immersed in a bathing solution. The computed results are in very good agreements with experimental data for the variation of volume swelling ratio with temperature. The influences of the salt concentration and initial fixed-charge density are discussed in detail on the variations of volume swelling ratio of hydrogels, mobile ion concentrations and electric potential of both interior hydrogels and exterior bathing solution.

  14. Application of ultra-small-angle X-ray scattering / X-ray photon correlation spectroscopy to relate equilibrium or non-equilibrium dynamics to microstructure

    NASA Astrophysics Data System (ADS)

    Allen, Andrew; Zhang, Fan; Levine, Lyle; Ilavsky, Jan

    2013-03-01

    Ultra-small-angle X-ray scattering (USAXS) can probe microstructures over the nanometer-to-micrometer scale range. Through use of a small instrument entrance slit, X-ray photon correlation spectroscopy (XPCS) exploits the partial coherence of an X-ray synchrotron undulator beam to provide unprecedented sensitivity to the dynamics of microstructural change. In USAXS/XPCS studies, the dynamics of local structures in a scale range of 100 nm to 1000 nm can be related to an overall hierarchical microstructure extending from 1 nm to more than 1000 nm. Using a point-detection scintillator mode, the equilibrium dynamics at ambient temperature of small particles (which move more slowly than nanoparticles) in aqueous suspension have been quantified directly for the first time. Using a USAXS-XPCS scanning mode for non-equilibrium dynamics incipient processes within dental composites have been elucidated, prior to effects becoming detectable using any other technique. Use of the Advanced Photon Source, an Office of Science User Facility operated for the United States Department of Energy (U.S. DOE) Office of Science by Argonne National Laboratory, was supported by the U.S. DOE under Contract No. DE-AC02-06CH11357.

  15. Monte Carlo calculations of LR115 detector response to 222Rn in the presence of 220Rn.

    PubMed

    Nikezić, D; Yu, K N

    2000-04-01

    The sensitivities (in m) of bare LR115 detectors and detectors in diffusion chambers to 222Rn and 220Rn chains are calculated by the Monte Carlo method. The partial sensitivities of bare detectors to the 222Rn chain are larger than those to the 220Rn chain, which is due to the higher energies of alpha particles in the 220Rn chain and the upper energy limit for detection for the LR115 detector. However, the total sensitivities are approximately equal because 220Rn is always in equilibrium with its first progeny, which is not the case for the 222Rn chain. The total sensitivity of bare LR115 detectors to 222Rn chain depends linearly on the equilibrium factor. The overestimation in 222Rn measurements with bare detectors caused by 220Rn in air can reach 10% in normal environmental conditions. An analytical relationship between the equilibrium factor and the ratio between track densities on the bare detector and the detector enclosed in chamber is given in the last part of the paper. This ratio is also affected by 220Rn, which can disturb the determination of the equilibrium factor.

  16. Bioproducts and environmental quality: Biofuels, greenhouse gases, and water quality

    NASA Astrophysics Data System (ADS)

    Ren, Xiaolin

    Promoting bio-based products is one oft-proposed solution to reduce GHG emissions because the feedstocks capture carbon, offsetting at least partially the carbon discharges resulting from use of the products. However, several life cycle analyses point out that while biofuels may emit less life cycle net carbon emissions than fossil fuels, they may exacerbate other parts of biogeochemical cycles, notably nutrient loads in the aquatic environment. In three essays, this dissertation explores the tradeoff between GHG emissions and nitrogen leaching associated with biofuel production using general equilibrium models. The first essay develops a theoretical general equilibrium model to calculate the second-best GHG tax with the existence of a nitrogen leaching distortion. The results indicate that the second-best GHG tax could be higher or lower than the first-best tax rates depending largely on the elasticity of substitution between fossil fuel and biofuel. The second and third essays employ computable general equilibrium models to further explore the tradeoff between GHG emissions and nitrogen leaching. The computable general equilibrium models also incorporate multiple biofuel pathways, i.e., biofuels made from different feedstocks using different processes, to identify the cost-effective combinations of biofuel pathways under different policies, and the corresponding economic and environmental impacts.

  17. Heterogeneous nucleation in multi-component vapor on a partially wettable charged conducting particle. II. The generalized Laplace, Gibbs-Kelvin, and Young equations and application to nucleation.

    PubMed

    Noppel, M; Vehkamäki, H; Winkler, P M; Kulmala, M; Wagner, P E

    2013-10-07

    Based on the results of a previous paper [M. Noppel, H. Vehkamäki, P. M. Winkler, M. Kulmala, and P. E. Wagner, J. Chem. Phys. 139, 134107 (2013)], we derive a thermodynamically consistent expression for reversible or minimal work needed to form a dielectric liquid nucleus of a new phase on a charged insoluble conducting sphere within a uniform macroscopic one- or multicomponent mother phase. The currently available model for ion-induced nucleation assumes complete spherical symmetry of the system, implying that the seed ion is immediately surrounded by the condensing liquid from all sides. We take a step further and treat more realistic geometries, where a cap-shaped liquid cluster forms on the surface of the seed particle. We derive the equilibrium conditions for such a cluster. The equalities of chemical potentials of each species between the nucleus and the vapor represent the conditions of chemical equilibrium. The generalized Young equation that relates contact angle with surface tensions, surface excess polarizations, and line tension, also containing the electrical contribution from triple line excess polarization, expresses the condition of thermodynamic equilibrium at three-phase contact line. The generalized Laplace equation gives the condition of mechanical equilibrium at vapor-liquid dividing surface: it relates generalized pressures in neighboring bulk phases at an interface with surface tension, excess surface polarization, and dielectric displacements in neighboring phases with two principal radii of surface curvature and curvatures of equipotential surfaces in neighboring phases at that point. We also re-express the generalized Laplace equation as a partial differential equation, which, along with electrostatic Laplace equations for bulk phases, determines the shape of a nucleus. We derive expressions that are suitable for calculations of the size and composition of a critical nucleus (generalized version of the classical Kelvin-Thomson equation).

  18. Direct Shear Failure in Reinforced Concrete Beams under Impulsive Loading

    DTIC Science & Technology

    1983-09-01

    115 References ............... ............................. 119 Tables . ............................. 124 Figures ............ 1..............30...8217. : = differentiable functions of time 1 = elastic modulus enhancement function 4) 41’ = constants for a given mode W’, = frequency w tfirst thickness-shear...are defined by linear partial differential equations. The analytic results are compared to data gathered on one-way slabs loaded with impulsive blast

  19. The Discrimination of Fully Randomized and Partially Randomized Responding from Nonrandomized Responding on the Sixteen Personality Factor Questionnaire-Fifth Edition

    ERIC Educational Resources Information Center

    Pietrzak, Dale; Korcuska, James S.

    2007-01-01

    This study examines the detection of various rates of noncontent responding on the Sixteen Personality Factor Questionnaire-Fifth Edition (R. Cattell, H. Eber, & M. Tatsuoka, 1970). The study used a sample of 237 adult volunteers. New scales were developed and tested. (Contains 3 tables.)

  20. Method of forming cavitated objects of controlled dimension

    DOEpatents

    Anderson, Paul R.; Miller, Wayne J.

    1982-01-01

    A method of controllably varying the dimensions of cavitated objects such as hollow spherical shells wherein a precursor shell is heated to a temperature above the shell softening temperature in an ambient atmosphere wherein the ratio of gases which are permeable through the shell wall at that temperature to gases which are impermeable through the shell wall is substantially greater than the corresponding ratio for gases contained within the precursor shell. As the shell expands, the partial pressures of permeable gases internally and externally of the shell approach and achieve equilibrium, so that the final shell size depends solely upon the difference in impermeable gas partial pressures and shell surface tension.

  1. Pollutant threshold concentration determination in marine ecosystems using an ecological interaction endpoint.

    PubMed

    Wang, Changyou; Liang, Shengkang; Guo, Wenting; Yu, Hua; Xing, Wenhui

    2015-09-01

    The threshold concentrations of pollutants are determined by extrapolating single-species effect data to community-level effects. This assumes the most sensitive endpoint of the life cycle of individuals and the species sensitivity distribution from single-species toxic effect tests, thus, ignoring the ecological interactions. The uncertainties due to this extrapolation can be partially overcome using the equilibrium point of a customized ecosystem. This method incorporates ecological interactions and integrates the effects on growth, survival, and ingestion into a single effect measure, the equilibrium point excursion in the customized ecosystem, in order to describe the toxic effects on plankton. A case study showed that the threshold concentration of copper calculated with the endpoint of the equilibrium point was 10 μg L(-1), which is significantly different from the threshold calculated with a single-species endpoint. The endpoint calculated using this method provides a more relevant measure of the ecological impact than any single individual-level endpoint. Copyright © 2015 Elsevier Ltd. All rights reserved.

  2. Towards Automated Bargaining in Electronic Markets: A Partially Two-Sided Competition Model

    NASA Astrophysics Data System (ADS)

    Gatti, Nicola; Lazaric, Alessandro; Restelli, Marcello

    This paper focuses on the prominent issue of automating bargaining agents within electronic markets. Models of bargaining in literature deal with settings wherein there are only two agents and no model satisfactorily captures settings in which there is competition among buyers, being they more than one, and analogously among sellers. In this paper, we extend the principal bargaining protocol, i.e. the alternating-offers protocol, to capture bargaining in markets. The model we propose is such that, in presence of a unique buyer and a unique seller, agents' equilibrium strategies are those in the original protocol. Moreover, we game theoretically study the considered game providing the following results: in presence of one-sided competition (more buyers and one seller or vice versa) we provide agents' equilibrium strategies for all the values of the parameters, in presence of two-sided competition (more buyers and more sellers) we provide an algorithm that produce agents' equilibrium strategies for a large set of the parameters and we experimentally evaluate its effectiveness.

  3. Dynamic Analysis of a Reaction-Diffusion Rumor Propagation Model

    NASA Astrophysics Data System (ADS)

    Zhao, Hongyong; Zhu, Linhe

    2016-06-01

    The rapid development of the Internet, especially the emergence of the social networks, leads rumor propagation into a new media era. Rumor propagation in social networks has brought new challenges to network security and social stability. This paper, based on partial differential equations (PDEs), proposes a new SIS rumor propagation model by considering the effect of the communication between the different rumor infected users on rumor propagation. The stabilities of a nonrumor equilibrium point and a rumor-spreading equilibrium point are discussed by linearization technique and the upper and lower solutions method, and the existence of a traveling wave solution is established by the cross-iteration scheme accompanied by the technique of upper and lower solutions and Schauder’s fixed point theorem. Furthermore, we add the time delay to rumor propagation and deduce the conditions of Hopf bifurcation and stability switches for the rumor-spreading equilibrium point by taking the time delay as the bifurcation parameter. Finally, numerical simulations are performed to illustrate the theoretical results.

  4. Polarity, cell division, and out-of-equilibrium dynamics control the growth of epithelial structures

    PubMed Central

    Cerruti, Benedetta; Puliafito, Alberto; Shewan, Annette M.; Yu, Wei; Combes, Alexander N.; Little, Melissa H.; Chianale, Federica; Primo, Luca; Serini, Guido; Mostov, Keith E.; Celani, Antonio

    2013-01-01

    The growth of a well-formed epithelial structure is governed by mechanical constraints, cellular apico-basal polarity, and spatially controlled cell division. Here we compared the predictions of a mathematical model of epithelial growth with the morphological analysis of 3D epithelial structures. In both in vitro cyst models and in developing epithelial structures in vivo, epithelial growth could take place close to or far from mechanical equilibrium, and was determined by the hierarchy of time-scales of cell division, cell–cell rearrangements, and lumen dynamics. Equilibrium properties could be inferred by the analysis of cell–cell contact topologies, and the nonequilibrium phenotype was altered by inhibiting ROCK activity. The occurrence of an aberrant multilumen phenotype was linked to fast nonequilibrium growth, even when geometric control of cell division was correctly enforced. We predicted and verified experimentally that slowing down cell division partially rescued a multilumen phenotype induced by altered polarity. These results improve our understanding of the development of epithelial organs and, ultimately, of carcinogenesis. PMID:24145168

  5. Equivalence of the EMD- and NEMD-based decomposition of thermal conductivity into microscopic building blocks.

    PubMed

    Matsubara, Hiroki; Kikugawa, Gota; Ishikiriyama, Mamoru; Yamashita, Seiji; Ohara, Taku

    2017-09-21

    Thermal conductivity of a material can be comprehended as being composed of microscopic building blocks relevant to the energy transfer due to a specific microscopic process or structure. The building block is called the partial thermal conductivity (PTC). The concept of PTC is essential to evaluate the contributions of various molecular mechanisms to heat conduction and has been providing detailed knowledge of the contribution. The PTC can be evaluated by equilibrium molecular dynamics (EMD) and non-equilibrium molecular dynamics (NEMD) in different manners: the EMD evaluation utilizes the autocorrelation of spontaneous heat fluxes in an equilibrium state whereas the NEMD one is based on stationary heat fluxes in a non-equilibrium state. However, it has not been fully discussed whether the two methods give the same PTC or not. In the present study, we formulate a Green-Kubo relation, which is necessary for EMD to calculate the PTCs equivalent to those by NEMD. Unlike the existing theories, our formulation is based on the local equilibrium hypothesis to describe a clear connection between EMD and NEMD simulations. The equivalence of the two derivations of PTCs is confirmed by the numerical results for liquid methane and butane. The present establishment of the EMD-NEMD correspondence makes the MD analysis of PTCs a robust way to clarify the microscopic origins of thermal conductivity.

  6. Polymorphism in the two-locus Levene model with nonepistatic directional selection.

    PubMed

    Bürger, Reinhard

    2009-11-01

    For the Levene model with soft selection in two demes, the maintenance of polymorphism at two diallelic loci is studied. Selection is nonepistatic and dominance is intermediate. Thus, there is directional selection in every deme and at every locus. We assume that selection is in opposite directions in the two demes because otherwise no polymorphism is possible. If at one locus there is no dominance, then a complete analysis of the dynamical and equilibrium properties is performed. In particular, a simple necessary and sufficient condition for the existence of an internal equilibrium and sufficient conditions for global asymptotic stability are obtained. These results are extended to deme-independent degree of dominance at one locus. A perturbation analysis establishes structural stability within the full parameter space. In the absence of genotype-environment interaction, which requires deme-independent dominance at both loci, nongeneric equilibrium behavior occurs, and the introduction of arbitrarily small genotype-environment interaction changes the equilibrium structure and may destroy stable polymorphism. The volume of the parameter space for which a (stable) two-locus polymorphism is maintained is computed numerically. It is investigated how this volume depends on the strength of selection and on the dominance relations. If the favorable allele is (partially) dominant in its deme, more than 20% of all parameter combinations lead to a globally asymptotically stable, fully polymorphic equilibrium.

  7. Emergent equilibrium in many-body optical bistability

    NASA Astrophysics Data System (ADS)

    Foss-Feig, Michael; Niroula, Pradeep; Young, Jeremy; Hafezi, Mohammad; Gorshkov, Alexey; Wilson, Ryan; Maghrebi, Mohammad

    2017-04-01

    Many-body systems constructed of quantum-optical building blocks can now be realized in experimental platforms ranging from exciton-polariton fluids to Rydberg gases, establishing a fascinating interface between traditional many-body physics and the non-equilibrium setting of cavity-QED. At this interface the standard intuitions of both fields are called into question, obscuring issues as fundamental as the role of fluctuations, dimensionality, and symmetry on the nature of collective behavior and phase transitions. We study the driven-dissipative Bose-Hubbard model, a minimal description of atomic, optical, and solid-state systems in which particle loss is countered by coherent driving. Despite being a lattice version of optical bistability-a foundational and patently non-equilibrium model of cavity-QED-the steady state possesses an emergent equilibrium description in terms of an Ising model. We establish this picture by identifying a limit in which the quantum dynamics is asymptotically equivalent to non-equilibrium Langevin equations, which support a phase transition described by model A of the Hohenberg-Halperin classification. Simulations of the Langevin equations corroborate this picture, producing results consistent with the behavior of a finite-temperature Ising model. M.F.M., J.T.Y., and A.V.G. acknowledge support by ARL CDQI, ARO MURI, NSF QIS, ARO, NSF PFC at JQI, and AFOSR. R.M.W. acknowledges partial support from the NSF under Grant No. PHYS-1516421. M.H. acknowledges support by AFOSR-MURI, ONR and Sloan Foundation.

  8. SU-E-T-548: How To Decrease Spine Dose In Patients Who Underwent Sterotactic Spine Radiosurgery?

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Acar, H; Altinok, A; Kucukmorkoc, E

    2014-06-01

    Purpose: Stereotactic radiosurgery for spine metastases involves irradiation using a single high dose fraction. The purpose of this study was to dosimetrically compare stereotactic spine radiosurgery(SRS) plans using a recently new volumetric modulated arc therapy(VMAT) technique against fix-field intensity-modulated radiotherapy(IMRT). Plans were evaluated for target conformity and spinal cord sparing. Methods: Fifteen previously treated patients were replanned using the Eclipse 10.1 TPS AAA calculation algorithm. IMRT plans with 7 fields were generated. The arc plans used 2 full arc configurations. Arc and IMRT plans were normalized and prescribed to deliver 16.0 Gy in a single fraction to 90% of themore » planning target volume(PTV). PTVs consisted of the vertebral body expanded by 3mm, excluding the PRV-cord, where the cord was expanded by 2mm.RTOG 0631 recommendations were applied for treatment planning. Partial spinal cord volume was defined as 5mm above and below the radiosurgery target volume. Plans were compared for conformity and gradient index as well as spinal cord sparing. Results: The conformity index values of fifteen patients for two different treatment planning techniques were shown in table 1. Conformity index values for 2 full arc planning (average CI=0.84) were higher than that of IMRT planning (average CI=0.79). The gradient index values of fifteen patients for two different treatment planning techniques were shown in table 2. Gradient index values for 2 full arc planning (average GI=3.58) were higher than that of IMRT planning (average GI=2.82).The spinal cord doses of fifteen patients for two different treatment planning techniques were shown in table 3. D0.35cc, D0.03cc and partial spinal cord D10% values in 2 full arc plannings (average D0.35cc=819.3cGy, D0.03cc=965.4cGy, 10%partial spinal=718.1cGy) were lower than IMRT plannings (average D0.35cc=877.4cGy, D0.03c=1071.4cGy, 10%partial spinal=805.1cGy). Conclusions: The two arc VMAT technique is superior to 7 field IMRT technique in terms of both spinal cord sparing and better conformity and gradient indexes.« less

  9. Tables and charts of equilibrium normal shock and shock-tube solutions for helium-hydrogen mixtures with velocities to 70 km/sec

    NASA Technical Reports Server (NTRS)

    Miller, C. G., III; Wilder, S. E.

    1974-01-01

    Equilibrium thermodynamic and flow properties are presented in tabulated and graphical form for moving, standing, and reflected normal shock waves into helium-hydrogen mixtures representative of proposed outer planet atmospheres. The volumetric compositions of these mixtures are 0.35He-0.65H2, 0.20He-0.80H2, and 0.05He-0.95H2. Properties include pressure, temperature, density, enthalpy, speed of sound, entropy, molecular-weight ratio, isentropic exponent, velocity, and species mole fractions. Incident (moving) shock velocities are varied from 4 to 70 km/sec for a range of initial pressure of 5 N/sq m to 100 kN/sq m. The present results are applicable to shock-tube flows and to free-flight conditions for a blunt body at high velocities. A working chart illustrating idealized shock-tube performance with a 0.20He-0.80H2 test gas and heated helium driver gas is also presented.

  10. Prediction of the P-leaching potential of arable soils in areas with high livestock densities*

    PubMed Central

    Werner, Wilfried; Trimborn, Manfred; Pihl, Uwe

    2006-01-01

    Due to long-term positive P-balances many surface soils in areas with high livestock density in Germany are oversupplied with available P, creating a potential for vertical P losses by leaching. In extensive studies to characterize the endangering of ground water to P pollution by chemical soil parameters it is shown that the available P content and the P concentration of the soil solution in the deeper soil layers, as indicators of the P-leaching potential, cannot be satisfactorily predicted from the available P content of the topsoils. The P equilibrium concentration in the soil solution directly above ground water table or the pipe drainage system highly depends on the relative saturation of the P-sorption capacity in this layer. A saturation index of <20% normally corresponds with P equilibrium concentrations of <0.2 mg P/L. Phytoremediation may reduce the P leaching potential of P-enriched soils only over a very long period. PMID:16773724

  11. Some problems of control of dynamical conditions of technological vibrating machines

    NASA Astrophysics Data System (ADS)

    Kuznetsov, N. K.; Lapshin, V. L.; Eliseev, A. V.

    2017-10-01

    The possibility of control of dynamical condition of the shakers that are designed for vibration treatment of parts interacting with granular media is discussed. The aim of this article is to develop the methodological basis of technology of creation of mathematical models of shake tables and the development of principles of formation of vibrational fields, estimation of their parameters and control of the structure vibration fields. Approaches to build mathematical models that take into account unilateral constraints, the relationships between elements, with the vibrating surface are developed. Methods intended to construct mathematical model of linear mechanical oscillation systems are used. Small oscillations about the position of static equilibrium are performed. The original method of correction of vibration fields by introduction of the oscillating system additional ties to the structure are proposed. Additional ties are implemented in the form of a mass-inertial device for changing the inertial parameters of the working body of the vibration table by moving the mass-inertial elements. The concept of monitoring the dynamic state of the vibration table based on the original measuring devices is proposed. Estimation for possible changes in dynamic properties is produced. The article is of interest for specialists in the field of creation of vibration technology machines and equipment.

  12. Methane oxidation in a crude oil contaminated aquifer: Delineation of aerobic reactions at the plume fringes

    USGS Publications Warehouse

    Amos, R.T.; Bekins, B.A.; Delin, G.N.; Cozzarelli, I.M.; Blowes, D.W.; Kirshtein, J.D.

    2011-01-01

    High resolution direct-push profiling over short vertical distances was used to investigate CH4 attenuation in a petroleum contaminated aquifer near Bemidji, Minnesota. The contaminant plume was delineated using dissolved gases, redox sensitive components, major ions, carbon isotope ratios in CH4 and CO2, and the presence of methanotrophic bacteria. Sharp redox gradients were observed near the water table. Shifts in ??13CCH4 from an average of - 57.6??? (?? 1.7???) in the methanogenic zone to - 39.6??? (?? 8.7???) at 105 m downgradient, strongly suggest CH4 attenuation through microbially mediated degradation. In the downgradient zone the aerobic/anaerobic transition is up to 0.5 m below the water table suggesting that transport of O2 across the water table is leading to aerobic degradation of CH4 at this interface. Dissolved N2 concentrations that exceeded those expected for water in equilibrium with the atmosphere indicated bubble entrapment followed by preferential stripping of O2 through aerobic degradation of CH4 or other hydrocarbons. Multivariate and cluster analysis were used to distinguish between areas of significant bubble entrapment and areas where other processes such as the infiltration of O 2 rich recharge water were important O2 transport mechanisms. ?? 2011 Elsevier B.V. All rights reserved.

  13. FTM-West : fuel treatment market model for U.S. West

    Treesearch

    Peter J. Ince; Andrew Kramp; Henry Spelter; Ken Skog; Dennis Dykstra

    2006-01-01

    This paper presents FTM–West, a partial market equilibrium model designed to project future wood market impacts of significantly expanded fuel treatment programs that could remove trees to reduce fire hazard on forestlands in the U.S. West. FTM–West was designed to account for structural complexities in marketing and utilization that arise from unconventional size...

  14. The impacts of NAFTA on U.S. and Canadian forest product exports to Mexico

    Treesearch

    Jeffrey P. Prestemon; Joseph Buongiorno

    1996-01-01

    The North American Free Trade Agreement (NAFTA) will lower barriers to trade and investment across the continent. This paper presents predictions of the effects of NAFTA on Mexico's imports of intermediate wood products, scrap and waste paper, pulp, and newsprint from the United States and Canada. Predictions were made with a partial equilibrium model. Model...

  15. Why Did Abolishing Fees Not Increase Public School Enrollment in Kenya? Africa Growth Initiative. Working Paper 4

    ERIC Educational Resources Information Center

    Bold, Tessa; Kimenyi, Mwangi S.; Mwabu, Germano; Sandefur, Justin

    2013-01-01

    A large empirical literature has shown that user fees significantly deter public service utilization in developing countries. While most of these results reflect partial equilibrium analysis, we find that the nationwide abolition of public school fees in Kenya in 2003 led to no increase in net public enrollment rates, but rather a dramatic shift…

  16. Impact of annealing on features of BCP coating on NiTi shape memory alloy: Preparation and physicochemical characterization

    NASA Astrophysics Data System (ADS)

    Dulski, Mateusz; Dudek, Karolina; Grelowski, Michał; Kubacki, Jerzy; Hertlein, Justyna; Wojtyniak, Marcin; Goryczka, Tomasz

    2018-04-01

    A multifunctional composite structure consisting of resorbable tricalcium phosphate with non-resorbable hydroxyapatite and NiTi shape memory alloy (SMA) has been manufactured to develop a biocompatible system for long-term implant applications. The hybrid system has been vacuum sintered to consolidate and form chemical binding between phosphate biomaterials and NiTi SMA. In this context, the impact of sintering on biomaterial's features in relation to initial material has been analyzed using a combination of structural and surface sensitive approaches. Moreover, a partial decomposition of the NiTi parent phase to the equilibrium Ti2Ni with cubic structure, and non-equilibrium Ti3Ni4 with hexagonal structure has been detected. Moreover, a sintering has provided a reconstruction of the orthophosphate surface through the disintegration of calcium phosphate material and increase of hydroxyapatite with smaller particles in volume. The biomaterial surface has become more enriched in calcium in relation to the initial composition, with a simultaneous decline of the roughness parameters due to the gradual consolidation of orthophosphates. Finally, surface modification accompanied with heat treatment has led to an increase of surface Young's modulus as an effect of partial recrystallization of calcium phosphates.

  17. Effect of Group-III precursors on unintentional gallium incorporation during epitaxial growth of InAlN layers by metalorganic chemical vapor deposition

    NASA Astrophysics Data System (ADS)

    Kim, Jeomoh; Ji, Mi-Hee; Detchprohm, Theeradetch; Dupuis, Russell D.; Fischer, Alec M.; Ponce, Fernando A.; Ryou, Jae-Hyun

    2015-09-01

    Unintentional incorporation of gallium (Ga) in InAlN layers grown with different molar flow rates of Group-III precursors by metalorganic chemical vapor deposition has been experimentally investigated. The Ga mole fraction in the InAl(Ga)N layer was increased significantly with the trimethylindium (TMIn) flow rate, while the trimethylaluminum flow rate controls the Al mole fraction. The evaporation of metallic Ga from the liquid phase eutectic system between the pyrolized In from injected TMIn and pre-deposited metallic Ga was responsible for the Ga auto-incorporation into the InAl(Ga)N layer. The theoretical calculation on the equilibrium vapor pressure of liquid phase Ga and the effective partial pressure of Group-III precursors based on growth parameters used in this study confirms the influence of Group-III precursors on Ga auto-incorporation. More Ga atoms can be evaporated from the liquid phase Ga on the surrounding surfaces in the growth chamber and then significant Ga auto-incorporation can occur due to the high equilibrium vapor pressure of Ga comparable to effective partial pressure of input Group-III precursors during the growth of InAl(Ga)N layer.

  18. A project based on multi-configuration Dirac-Fock calculations for plasma spectroscopy

    NASA Astrophysics Data System (ADS)

    Comet, M.; Pain, J.-C.; Gilleron, F.; Piron, R.

    2017-09-01

    We present a project dedicated to hot plasma spectroscopy based on a Multi-Configuration Dirac-Fock (MCDF) code, initially developed by J. Bruneau. The code is briefly described and the use of the transition state method for plasma spectroscopy is detailed. Then an opacity code for local-thermodynamic-equilibrium plasmas using MCDF data, named OPAMCDF, is presented. Transition arrays for which the number of lines is too large to be handled in a Detailed Line Accounting (DLA) calculation can be modeled within the Partially Resolved Transition Array method or using the Unresolved Transition Arrays formalism in jj-coupling. An improvement of the original Partially Resolved Transition Array method is presented which gives a better agreement with DLA computations. Comparisons with some absorption and emission experimental spectra are shown. Finally, the capability of the MCDF code to compute atomic data required for collisional-radiative modeling of plasma at non local thermodynamic equilibrium is illustrated. In addition to photoexcitation, this code can be used to calculate photoionization, electron impact excitation and ionization cross-sections as well as autoionization rates in the Distorted-Wave or Close Coupling approximations. Comparisons with cross-sections and rates available in the literature are discussed.

  19. Modelling alkali metal emissions in large-eddy simulation of a preheated pulverised-coal turbulent jet flame using tabulated chemistry

    NASA Astrophysics Data System (ADS)

    Wan, Kaidi; Xia, Jun; Vervisch, Luc; Liu, Yingzu; Wang, Zhihua; Cen, Kefa

    2018-03-01

    The numerical modelling of alkali metal reacting dynamics in turbulent pulverised-coal combustion is discussed using tabulated sodium chemistry in large eddy simulation (LES). A lookup table is constructed from a detailed sodium chemistry mechanism including five sodium species, i.e. Na, NaO, NaO2, NaOH and Na2O2H2, and 24 elementary reactions. This sodium chemistry table contains four coordinates, i.e. the equivalence ratio, the mass fraction of the sodium element, the gas-phase temperature, and a progress variable. The table is first validated against the detailed sodium chemistry mechanism by zero-dimensional simulations. Then, LES of a turbulent pulverised-coal jet flame is performed and major coal-flame parameters compared against experiments. The chemical percolation devolatilisation (CPD) model and the partially stirred reactor (PaSR) model are employed to predict coal pyrolysis and gas-phase combustion, respectively. The response of the five sodium species in the pulverised-coal jet flame is subsequently examined. Finally, a systematic global sensitivity analysis of the sodium lookup table is performed and the accuracy of the proposed tabulated sodium chemistry approach has been calibrated.

  20. Multiple-methods investigation of recharge at a humid-region fractured rock site, Pennsylvania, USA

    USGS Publications Warehouse

    Heppner, C.S.; Nimmo, J.R.; Folmar, G.J.; Gburek, W.J.; Risser, D.W.

    2007-01-01

    Lysimeter-percolate and well-hydrograph analyses were combined to evaluate recharge for the Masser Recharge Site (central Pennsylvania, USA). In humid regions, aquifer recharge through an unconfined low-porosity fractured-rock aquifer can cause large magnitude water-table fluctuations over short time scales. The unsaturated hydraulic characteristics of the subsurface porous media control the magnitude and timing of these fluctuations. Data from multiple sets of lysimeters at the site show a highly seasonal pattern of percolate and exhibit variability due to both installation factors and hydraulic property heterogeneity. Individual event analysis of well hydrograph data reveals the primary influences on water-table response, namely rainfall depth, rainfall intensity, and initial water-table depth. Spatial and seasonal variability in well response is also evident. A new approach for calculating recharge from continuous water-table elevation records using a master recession curve (MRC) is demonstrated. The recharge estimated by the MRC approach when assuming a constant specific yield is seasonal to a lesser degree than the recharge estimate resulting from the lysimeter analysis. Partial reconciliation of the two recharge estimates is achieved by considering a conceptual model of flow processes in the highly-heterogeneous underlying fractured porous medium. ?? Springer-Verlag 2007.

  1. Modelling stream aquifer seepage in an alluvial aquifer: an improved loosing-stream package for MODFLOW

    NASA Astrophysics Data System (ADS)

    Osman, Yassin Z.; Bruen, Michael P.

    2002-07-01

    Seepage from a stream, which partially penetrates an unconfined alluvial aquifer, is studied for the case when the water table falls below the streambed level. Inadequacies are identified in current modelling approaches to this situation. A simple and improved method of incorporating such seepage into groundwater models is presented. This considers the effect on seepage flow of suction in the unsaturated part of the aquifer below a disconnected stream and allows for the variation of seepage with water table fluctuations. The suggested technique is incorporated into the saturated code MODFLOW and is tested by comparing its predictions with those of a widely used variably saturated model, SWMS_2D simulating water flow and solute transport in two-dimensional variably saturated media. Comparisons are made of both seepage flows and local mounding of the water table. The suggested technique compares very well with the results of variably saturated model simulations. Most currently used approaches are shown to underestimate the seepage and associated local water table mounding, sometimes substantially. The proposed method is simple, easy to implement and requires only a small amount of additional data about the aquifer hydraulic properties.

  2. Amyloidogenesis of Natively Unfolded Proteins

    PubMed Central

    Uversky, Vladimir N.

    2009-01-01

    Aggregation and subsequent development of protein deposition diseases originate from conformational changes in corresponding amyloidogenic proteins. The accumulated data support the model where protein fibrillogenesis proceeds via the formation of a relatively unfolded amyloidogenic conformation, which shares many structural properties with the pre-molten globule state, a partially folded intermediate first found during the equilibrium and kinetic (un)folding studies of several globular proteins and later described as one of the structural forms of natively unfolded proteins. The flexibility of this structural form is essential for the conformational rearrangements driving the formation of the core cross-beta structure of the amyloid fibril. Obviously, molecular mechanisms describing amyloidogenesis of ordered and natively unfolded proteins are different. For ordered protein to fibrillate, its unique and rigid structure has to be destabilized and partially unfolded. On the other hand, fibrillogenesis of a natively unfolded protein involves the formation of partially folded conformation; i.e., partial folding rather than unfolding. In this review recent findings are surveyed to illustrate some unique features of the natively unfolded proteins amyloidogenesis. PMID:18537543

  3. Prediction of hydrodynamics and chemistry of confined turbulent methane-air flames with attention to formation of oxides of nitrogen

    NASA Technical Reports Server (NTRS)

    Elghobashi, S.; Spalding, D. B.; Srivatsa, S. K.

    1977-01-01

    A formulation of the governing partial differential equations for fluid flow and reacting chemical species in a tubular combustor is presented. A numerical procedure for the solution of the governing differential equations is described, and models for chemical equilibrium and chemical kinetics calculations are presented. The chemical equilibrium model is used to characterize the hydrocarbon reactions. The chemical kinetics model is used to predict the concentrations of the oxides of nitrogen. The combustor consists of a cylindrical duct of varying cross sections with concentric streams of gaseous fuel and air entering the duct at one end. Four sample cases with specified inlet and boundary conditions are considered, and the results are discussed

  4. Gas-phase water-mediated equilibrium between methylglyoxal and its geminal diol

    PubMed Central

    Axson, Jessica L.; Takahashi, Kaito; De Haan, David O.; Vaida, Veronica

    2010-01-01

    In aqueous solution, aldehydes, and to a lesser extent ketones, hydrate to form geminal diols. We investigate the hydration of methylglyoxal (MG) in the gas phase, a process not previously considered to occur in water-restricted environments. In this study, we spectroscopically identified methylglyoxal diol (MGD) and obtained the gas-phase partial pressures of MG and MGD. These results, in conjunction with the relative humidity, were used to obtain the equilibrium constant, KP, for the water-mediated hydration of MG in the gas phase. The Gibbs free energy for this process, ΔG°, obtained as a result, suggests a larger than expected gas-phase diol concentration. This may have significant implications for understanding the role of organics in atmospheric chemistry. PMID:20142510

  5. Group theoretic approach for solving the problem of diffusion of a drug through a thin membrane

    NASA Astrophysics Data System (ADS)

    Abd-El-Malek, Mina B.; Kassem, Magda M.; Meky, Mohammed L. M.

    2002-03-01

    The transformation group theoretic approach is applied to study the diffusion process of a drug through a skin-like membrane which tends to partially absorb the drug. Two cases are considered for the diffusion coefficient. The application of one parameter group reduces the number of independent variables by one, and consequently the partial differential equation governing the diffusion process with the boundary and initial conditions is transformed into an ordinary differential equation with the corresponding conditions. The obtained differential equation is solved numerically using the shooting method, and the results are illustrated graphically and in tables.

  6. Unsteady boundary layer flow over a sphere in a porous medium

    NASA Astrophysics Data System (ADS)

    Mohammad, Nurul Farahain; Waini, Iskandar; Kasim, Abdul Rahman Mohd; Majid, Nurazleen Abdul

    2017-08-01

    This study focuses on the problem of unsteady boundary layer flow over a sphere in a porous medium. The governing equations which consists of a system of dimensional partial differential equations is applied with dimensionless parameter in order to attain non-dimensional partial differential equations. Later, the similarity transformation is performed in order to attain nonsimilar governing equations. Afterwards, the nonsimilar governing equations are solved numerically by using the Keller-Box method in Octave programme. The effect of porosity parameter is examined on separation time, velocity profile and skin friction of the unsteady flow. The results attained are presented in the form of table and graph.

  7. The non-equilibrium allele frequency spectrum in a Poisson random field framework.

    PubMed

    Kaj, Ingemar; Mugal, Carina F

    2016-10-01

    In population genetic studies, the allele frequency spectrum (AFS) efficiently summarizes genome-wide polymorphism data and shapes a variety of allele frequency-based summary statistics. While existing theory typically features equilibrium conditions, emerging methodology requires an analytical understanding of the build-up of the allele frequencies over time. In this work, we use the framework of Poisson random fields to derive new representations of the non-equilibrium AFS for the case of a Wright-Fisher population model with selection. In our approach, the AFS is a scaling-limit of the expectation of a Poisson stochastic integral and the representation of the non-equilibrium AFS arises in terms of a fixation time probability distribution. The known duality between the Wright-Fisher diffusion process and a birth and death process generalizing Kingman's coalescent yields an additional representation. The results carry over to the setting of a random sample drawn from the population and provide the non-equilibrium behavior of sample statistics. Our findings are consistent with and extend a previous approach where the non-equilibrium AFS solves a partial differential forward equation with a non-traditional boundary condition. Moreover, we provide a bridge to previous coalescent-based work, and hence tie several frameworks together. Since frequency-based summary statistics are widely used in population genetics, for example, to identify candidate loci of adaptive evolution, to infer the demographic history of a population, or to improve our understanding of the underlying mechanics of speciation events, the presented results are potentially useful for a broad range of topics. Copyright © 2016 Elsevier Inc. All rights reserved.

  8. Gaussian random bridges and a geometric model for information equilibrium

    NASA Astrophysics Data System (ADS)

    Mengütürk, Levent Ali

    2018-03-01

    The paper introduces a class of conditioned stochastic processes that we call Gaussian random bridges (GRBs) and proves some of their properties. Due to the anticipative representation of any GRB as the sum of a random variable and a Gaussian (T , 0) -bridge, GRBs can model noisy information processes in partially observed systems. In this spirit, we propose an asset pricing model with respect to what we call information equilibrium in a market with multiple sources of information. The idea is to work on a topological manifold endowed with a metric that enables us to systematically determine an equilibrium point of a stochastic system that can be represented by multiple points on that manifold at each fixed time. In doing so, we formulate GRB-based information diversity over a Riemannian manifold and show that it is pinned to zero over the boundary determined by Dirac measures. We then define an influence factor that controls the dominance of an information source in determining the best estimate of a signal in the L2-sense. When there are two sources, this allows us to construct information equilibrium as a functional of a geodesic-valued stochastic process, which is driven by an equilibrium convergence rate representing the signal-to-noise ratio. This leads us to derive price dynamics under what can be considered as an equilibrium probability measure. We also provide a semimartingale representation of Markovian GRBs associated with Gaussian martingales and a non-anticipative representation of fractional Brownian random bridges that can incorporate degrees of information coupling in a given system via the Hurst exponent.

  9. Botrytis californica, a new cryptic species in the B. cinerea species complex causing gray mold in blueberries and table grapes.

    PubMed

    Saito, S; Margosan, D; Michailides, T J; Xiao, C L

    2016-01-01

    The Botrytis cinerea species complex comprises two cryptic species, originally referred to Group I and Group II based on Bc-hch gene RFLP haplotyping. Group I was described as a new cryptic species B. pseudocinerea During a survey of Botrytis spp. causing gray mold in blueberries and table grapes in the Central Valley of California, six isolates, three from blueberries and three from table grapes, were placed in Group I but had a distinct morphological character with conidiophores significantly longer than those of B. cinerea and B. pseudocinerea We compared these with B. cinerea and B. pseudocinerea by examining morphological and physiological characters, sensitivity to fenhexamid and phylogenetic analysis inferred from sequences of three nuclear genes. Phylogenetic analysis with the three partial gene sequences encoding glyceraldehyde-3-phosate dehydrogenase (G3PDH), heat-shock protein 60 (HSP60) and DNA-dependent RNA polymerase subunit II (RPB2) supported the proposal of a new Botrytis species, B. californica, which is closely related genetically to B. cinerea, B. pseudocinerea and B. sinoviticola, all known as causal agents of gray mold of grapes. Botrytis californica caused decay on blueberry and table grape fruit inoculated with the fungus. This study suggests that B. californica is a cryptic species sympatric with B. cinerea on blueberries and table grapes in California. © 2016 by The Mycological Society of America.

  10. Evaluating equilibrium and non-equilibrium transport of bromide and isoproturon in disturbed and undisturbed soil columns.

    PubMed

    Dousset, S; Thevenot, M; Pot, V; Simunek, J; Andreux, F

    2007-12-07

    In this study, displacement experiments of isoproturon were conducted in disturbed and undisturbed columns of a silty clay loam soil under similar rainfall intensities. Solute transport occurred under saturated conditions in the undisturbed soil and under unsaturated conditions in the sieved soil because of a greater bulk density of the compacted undisturbed soil compared to the sieved soil. The objective of this work was to determine transport characteristics of isoproturon relative to bromide tracer. Triplicate column experiments were performed with sieved (structure partially destroyed to simulate conventional tillage) and undisturbed (structure preserved) soils. Bromide experimental breakthrough curves were analyzed using convective-dispersive and dual-permeability (DP) models (HYDRUS-1D). Isoproturon breakthrough curves (BTCs) were analyzed using the DP model that considered either chemical equilibrium or non-equilibrium transport. The DP model described the bromide elution curves of the sieved soil columns well, whereas it overestimated the tailing of the bromide BTCs of the undisturbed soil columns. A higher degree of physical non-equilibrium was found in the undisturbed soil, where 56% of total water was contained in the slow-flow matrix, compared to 26% in the sieved soil. Isoproturon BTCs were best described in both sieved and undisturbed soil columns using the DP model combined with the chemical non-equilibrium. Higher degradation rates were obtained in the transport experiments than in batch studies, for both soils. This was likely caused by hysteresis in sorption of isoproturon. However, it cannot be ruled out that higher degradation rates were due, at least in part, to the adopted first-order model. Results showed that for similar rainfall intensity, physical and chemical non-equilibrium were greater in the saturated undisturbed soil than in the unsaturated sieved soil. Results also suggested faster transport of isoproturon in the undisturbed soil due to higher preferential flow and lower fraction of equilibrium sorption sites.

  11. Evaluating equilibrium and non-equilibrium transport of bromide and isoproturon in disturbed and undisturbed soil columns

    NASA Astrophysics Data System (ADS)

    Dousset, S.; Thevenot, M.; Pot, V.; Šimunek, J.; Andreux, F.

    2007-12-01

    In this study, displacement experiments of isoproturon were conducted in disturbed and undisturbed columns of a silty clay loam soil under similar rainfall intensities. Solute transport occurred under saturated conditions in the undisturbed soil and under unsaturated conditions in the sieved soil because of a greater bulk density of the compacted undisturbed soil compared to the sieved soil. The objective of this work was to determine transport characteristics of isoproturon relative to bromide tracer. Triplicate column experiments were performed with sieved (structure partially destroyed to simulate conventional tillage) and undisturbed (structure preserved) soils. Bromide experimental breakthrough curves were analyzed using convective-dispersive and dual-permeability (DP) models (HYDRUS-1D). Isoproturon breakthrough curves (BTCs) were analyzed using the DP model that considered either chemical equilibrium or non-equilibrium transport. The DP model described the bromide elution curves of the sieved soil columns well, whereas it overestimated the tailing of the bromide BTCs of the undisturbed soil columns. A higher degree of physical non-equilibrium was found in the undisturbed soil, where 56% of total water was contained in the slow-flow matrix, compared to 26% in the sieved soil. Isoproturon BTCs were best described in both sieved and undisturbed soil columns using the DP model combined with the chemical non-equilibrium. Higher degradation rates were obtained in the transport experiments than in batch studies, for both soils. This was likely caused by hysteresis in sorption of isoproturon. However, it cannot be ruled out that higher degradation rates were due, at least in part, to the adopted first-order model. Results showed that for similar rainfall intensity, physical and chemical non-equilibrium were greater in the saturated undisturbed soil than in the unsaturated sieved soil. Results also suggested faster transport of isoproturon in the undisturbed soil due to higher preferential flow and lower fraction of equilibrium sorption sites.

  12. The ATPG Attack for Reverse Engineering of Combinational Hybrid Custom-Programmable Circuits

    DTIC Science & Technology

    2017-03-23

    The ATPG Attack for Reverse Engineering of Combinational Hybrid Custom- Programmable Circuits Raza Shafiq Hamid Mahmoodi Houman Homayoun Hassan... programmable circuits. While functionality of programmable cells are only known to trusted parties, effective techniques for activation and propagation...of the cells are introduced. The ATPG attack carefully studies dependency of programmable cells to develop their (partial) truth tables. Results

  13. 40 CFR Table 6 to Subpart Vvvvvv... - Emission Limits and Compliance Requirements for Wastewater Systems

    Code of Federal Regulations, 2011 CFR

    2011-07-01

    ... hazardous waste, or hard pipe the entire wastewater stream to a point of transfer for offsite treatment as a... treatment i. Maintain records identifying each wastewater stream and documenting the type of treatment that... partially soluble HAP at a concentration ≥10,000 ppmw and separate organic and water phases a. Use a...

  14. Brazilian Arms Production: Partial Dependence

    DTIC Science & Technology

    1988-09-01

    neighbors, before the Great Depression Brazil relied upon the export of primary commodities such as coffee, sugar and cocoa for its hard currency...24 Conclusions 26 Appendix 29 - VII - TABLES A.l. Brazilian arms exports and imports, 1968-86 30 A.2. Destination of...Embracr aircraft delivered outside of Brazil, 1975- 83 31 FIGURE 1. Brazilian arms exports and imports, 1968-86 25 IX - ACKNOWLEDGMENTS

  15. Design of a radiation facility for very small specimens used in radiobiology studies

    NASA Astrophysics Data System (ADS)

    Rodriguez, Manuel; Jeraj, Robert

    2008-06-01

    A design of a radiation facility for very small specimens used in radiobiology is presented. This micro-irradiator has been primarily designed to irradiate partial bodies in zebrafish embryos 3-4 mm in length. A miniature x-ray, 50 kV photon beam, is used as a radiation source. The source is inserted in a cylindrical brass collimator that has a pinhole of 1.0 mm in diameter along the central axis to produce a pencil photon beam. The collimator with the source is attached underneath a computer-controlled movable table which holds the specimens. Using a 45° tilted mirror, a digital camera, connected to the computer, takes pictures of the specimen and the pinhole collimator. From the image provided by the camera, the relative distance from the specimen to the pinhole axis is calculated and coordinates are sent to the movable table to properly position the samples in the beam path. Due to its monitoring system, characteristic of the radiation beam, accuracy and precision of specimen positioning, and automatic image-based specimen recognition, this radiation facility is a suitable tool to irradiate partial bodies in zebrafish embryos, cell cultures or any other small specimen used in radiobiology research.

  16. Effects of partial slip boundary condition and radiation on the heat and mass transfer of MHD-nanofluid flow

    NASA Astrophysics Data System (ADS)

    Abd Elazem, Nader Y.; Ebaid, Abdelhalim

    2017-12-01

    In this paper, the effect of partial slip boundary condition on the heat and mass transfer of the Cu-water and Ag-water nanofluids over a stretching sheet in the presence of magnetic field and radiation. Such partial slip boundary condition has attracted much attention due to its wide applications in industry and chemical engineering. The flow is basically governing by a system of partial differential equations which are reduced to a system of ordinary differential equations. This system has been exactly solved, where exact analytical expression has been obtained for the fluid velocity in terms of exponential function, while the temperature distribution, and the nanoparticles concentration are expressed in terms of the generalized incomplete gamma function. In addition, explicit formulae are also derived from the rates of heat transfer and mass transfer. The effects of the permanent parameters on the skin friction, heat transfer coefficient, rate of mass transfer, velocity, the temperature profile, and concentration profile have been discussed through tables and graphs.

  17. Standard Electrode Potentials Involving Radicals in Aqueous Solution: Inorganic Radicals

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Armstrong, David A.; Huie, Robert E.; Koppenol, Willem H.

    2015-12-01

    Recommendations are made for standard potentials involving select inorganic radicals in aqueous solution at 25 °C. These recommendations are based on a critical and thorough literature review and also by performing derivations from various literature reports. The recommended data are summarized in tables of standard potentials, Gibbs energies of formation, radical pK a’s, and hemicolligation equilibrium constants. In all cases, current best estimates of the uncertainties are provided. An extensive set of Data Sheets is appended that provide original literature references, summarize the experimental results, and describe the decisions and procedures leading to each of the recommendations

  18. Classical and Quantum Thermal Physics

    NASA Astrophysics Data System (ADS)

    Prasad, R.

    2016-11-01

    List of figures; List of tables; Preface; Acknowledgement; Dedication; 1. The kinetic theory of gases; 2. Ideal to real gas, viscosity, conductivity and diffusion; 3. Thermodynamics: definitions and Zeroth law; 4. First Law of Thermodynamics and some of its applications; 5. Second Law of Thermodynamics and some of its applications; 6. TdS equations and their applications; 7. Thermodynamic functions, potentials, Maxwell equations, the Third Law and equilibrium; 8. Some applications of thermodynamics to problems of physics and engineering; 9. Application of thermodynamics to chemical reactions; 10. Quantum thermodynamics; 11. Some applications of quantum thermodynamics; 12. Introduction to the thermodynamics of irreversible processes; Index.

  19. Recommendations for terminology and databases for biochemical thermodynamics.

    PubMed

    Alberty, Robert A; Cornish-Bowden, Athel; Goldberg, Robert N; Hammes, Gordon G; Tipton, Keith; Westerhoff, Hans V

    2011-05-01

    Chemical equations are normally written in terms of specific ionic and elemental species and balance atoms of elements and electric charge. However, in a biochemical context it is usually better to write them with ionic reactants expressed as totals of species in equilibrium with each other. This implies that atoms of elements assumed to be at fixed concentrations, such as hydrogen at a specified pH, should not be balanced in a biochemical equation used for thermodynamic analysis. However, both kinds of equations are needed in biochemistry. The apparent equilibrium constant K' for a biochemical reaction is written in terms of such sums of species and can be used to calculate standard transformed Gibbs energies of reaction Δ(r)G'°. This property for a biochemical reaction can be calculated from the standard transformed Gibbs energies of formation Δ(f)G(i)'° of reactants, which can be calculated from the standard Gibbs energies of formation of species Δ(f)G(j)° and measured apparent equilibrium constants of enzyme-catalyzed reactions. Tables of Δ(r)G'° of reactions and Δ(f)G(i)'° of reactants as functions of pH and temperature are available on the web, as are functions for calculating these properties. Biochemical thermodynamics is also important in enzyme kinetics because apparent equilibrium constant K' can be calculated from experimentally determined kinetic parameters when initial velocities have been determined for both forward and reverse reactions. Specific recommendations are made for reporting experimental results in the literature. Copyright © 2011 Elsevier B.V. All rights reserved.

  20. Design and objectives of FTM-West model

    Treesearch

    Peter J. Ince; Henry Spelter

    2006-01-01

    The FTM-West (“fuel treatment market” model for U.S. West) is a dynamic partial market equilibrium model of regional softwood timber and wood product markets, designed to project future market impacts of expanded fuel treatment programs that remove trees to reduce fire hazard on forestlands in the U.S. West. The model solves sequentially the annual equilibria in wood...

  1. DOE Office of Scientific and Technical Information (OSTI.GOV)

    Berrondo, M.

    We calculate the equilibrium configurations of a system of deuterium atoms absorbed in palladium. The interaction potential energy is taken as a sum of pair functionals including non-additive effects, which are crucial for this case. We conclude from our calculations that the most probable configuration for the deuterium in the {beta}-phase of PdD involves at least a partial occupation of the tetrahedral sites of the fcc palladium unit cell.

  2. U.S. forest products module : a technical document supporting the Forest Service 2010 RPA Assessment

    Treesearch

    Peter J. Ince; Andrew D. Kramp; Kenneth E. Skog; Henry N. Spelter; David N. Wear

    2011-01-01

    The U.S. Forest Products Module (USFPM) is a partial market equilibrium model of the U.S. forest sector that operates within the Global Forest Products Model (GFPM) to provide long-range timber market projections in relation to global economic scenarios. USFPM was designed specifically for the 2010 RPA forest assessment, but it is being used also in other applications...

  3. Metal-organic complexes in geochemical processes: temperature dependence of the standard thermodynamic properties of aqueous complexes between metal cations and dicarboxylate ligands

    NASA Astrophysics Data System (ADS)

    Prapaipong, Panjai; Shock, Everett L.; Koretsky, Carla M.

    1999-10-01

    By combining results from regression and correlation methods, standard state thermodynamic properties for aqueous complexes between metal cations and divalent organic acid ligands (oxalate, malonate, succinate, glutarate, and adipate) are evaluated and applied to geochemical processes. Regression of experimental standard-state equilibrium constants with the revised Helgeson-Kirkham-Flowers (HKF) equation of state yields standard partial molal entropies (S¯°) of aqueous metal-organic complexes, which allow determination of thermodynamic properties of the complexes at elevated temperatures. In cases where S¯° is not available from either regression or calorimetric measurement, the values of S¯° can be estimated from a linear correlation between standard partial molal entropies of association (ΔS¯°r) and standard partial molal entropies of aqueous cations (S¯°M). The correlation is independent of cation charge, which makes it possible to predict S¯° for complexes between divalent organic acids and numerous metal cations. Similarly, correlations between standard Gibbs free energies of association of metal-organic complexes (ΔḠ°r) and Gibbs free energies of formation (ΔḠ°f) for divalent metal cations allow estimates of standard-state equilibrium constants where experimental data are not available. These correlations are found to be a function of ligand structure and cation charge. Predicted equilibrium constants for dicarboxylate complexes of numerous cations were included with those for inorganic and other organic complexes to study the effects of dicarboxylate complexes on the speciation of metals and organic acids in oil-field brines. Relatively low concentrations of oxalic and malonic acids affect the speciation of cations more than similar concentrations of succinic, glutaric, and adipic acids. However, the extent to which metal-dicarboxylate complexes contribute to the speciation of dissolved metals depends on the type of dicarboxylic acid ligand; relative concentration of inorganic, mono-, and dicarboxylate ligands; and the type of metal cation. As an example, in the same solution, dicarboxylic acids have a greater influence on the speciation of Fe+2 and Mg+2 than on the speciation of Zn+2 and Mn+2.

  4. Viscous fingering with partially miscible fluids

    NASA Astrophysics Data System (ADS)

    Fu, Xiaojing; Cueto-Felgueroso, Luis; Juanes, Ruben

    2017-10-01

    Viscous fingering—the fluid-mechanical instability that takes place when a low-viscosity fluid displaces a high-viscosity fluid—has traditionally been studied under either fully miscible or fully immiscible fluid systems. Here we study the impact of partial miscibility (a common occurrence in practice) on the fingering dynamics. Through a careful design of the thermodynamic free energy of a binary mixture, we develop a phase-field model of fluid-fluid displacements in a Hele-Shaw cell for the general case in which the two fluids have limited (but nonzero) solubility into one another. We show, by means of high-resolution numerical simulations, that partial miscibility exerts a powerful control on the degree of fingering: fluid dissolution hinders fingering while fluid exsolution enhances fingering. We also show that, as a result of the interplay between compositional exchange and the hydrodynamic pattern-forming process, stronger fingering promotes the system to approach thermodynamic equilibrium more quickly.

  5. The change of steel surface chemistry regarding oxygen partial pressure and dew point

    NASA Astrophysics Data System (ADS)

    Norden, Martin; Blumenau, Marc; Wuttke, Thiemo; Peters, Klaus-Josef

    2013-04-01

    By investigating the surface state of a Ti-IF, TiNb-IF and a MnCr-DP after several series of intercritical annealing, the impact of the annealing gas composition on the selective oxidation process is discussed. On behalf of the presented results, it can be concluded that not the general oxygen partial pressure in the annealing furnace, which is a result of the equilibrium reaction of water and hydrogen, is the main driving force for the selective oxidation process. It is shown that the amounts of adsorbed gases at the strip surface and the effective oxygen partial pressure resulting from the adsorbed gases, which is mainly dependent on the water content of the annealing furnace, is driving the selective oxidation processes occurring during intercritical annealing. Thus it is concluded, that for industrial applications the dew point must be the key parameter value for process control.

  6. Equilibrium Gold Nanoclusters Quenched with Biodegradable Polymers

    PubMed Central

    Murthy, Avinash K.; Stover, Robert J.; Borwankar, Ameya U.; Nie, Golay D.; Gourisankar, Sai; Truskett, Thomas M.; Sokolov, Konstantin V.; Johnston, Keith P.

    2013-01-01

    Although sub-100 nm nanoclusters of metal nanoparticles are of interest in many fields including biomedical imaging, sensors and catalysis, it has been challenging to control their morphologies and chemical properties. Herein, a new concept is presented to assemble equilibrium Au nanoclusters of controlled size by tuning the colloidal interactions with a polymeric stabilizer, PLA(1k)-b-PEG(10k)-b-PLA(1k). The nanoclusters form upon mixing a dispersion of ~5 nm Au nanospheres with a polymer solution followed by partial solvent evaporation. A weakly adsorbed polymer quenches the equilibrium nanocluster size and provides steric stabilization. Nanocluster size is tuned from ~20 nm to ~40 nm by experimentally varying the final Au nanoparticle concentration and the polymer/Au ratio, along with the charge on the initial Au nanoparticle surface. Upon biodegradation of the quencher, the nanoclusters reversibly and fully dissociate to individual ~5 nm primary particles. Equilibrium cluster size is predicted semi-quantitatively with a free energy model that balances short-ranged depletion and van der Waals attractions with longer-ranged electrostatic repulsion, as a function of the Au and polymer concentrations. The close spacings of the Au nanoparticles in the clusters produce strong NIR extinction over a broad range of wavelengths from 650 to 900 nm, which is of practical interest in biomedical imaging. PMID:23230905

  7. Progress Toward an Efficient and General CFD Tool for Propulsion Design/Analysis

    NASA Technical Reports Server (NTRS)

    Cox, C. F.; Cinnella, P.; Westmoreland, S.

    1996-01-01

    The simulation of propulsive flows inherently involves chemical activity. Recent years have seen substantial strides made in the development of numerical schemes for reacting flowfields, in particular those involving finite-rate chemistry. However, finite-rate calculations are computationally intensive and require knowledge of the actual kinetics, which are not always known with sufficient accuracy. Alternatively, flow simulations based on the assumption of local chemical equilibrium are capable of obtaining physically reasonable results at far less computational cost. The present study summarizes the development of efficient numerical techniques for the simulation of flows in local chemical equilibrium, whereby a 'Black Box' chemical equilibrium solver is coupled to the usual gasdynamic equations. The generalization of the methods enables the modelling of any arbitrary mixture of thermally perfect gases, including air, combustion mixtures and plasmas. As demonstration of the potential of the methodologies, several solutions, involving reacting and perfect gas flows, will be presented. Included is a preliminary simulation of the SSME startup transient. Future enhancements to the proposed techniques will be discussed, including more efficient finite-rate and hybrid (partial equilibrium) schemes. The algorithms that have been developed and are being optimized provide for an efficient and general tool for the design and analysis of propulsion systems.

  8. Kinetics and Equilibrium of Age-Induced Precipitation in Cu-4 At. Pct Ti Binary Alloy

    NASA Astrophysics Data System (ADS)

    Semboshi, Satoshi; Amano, Shintaro; Fu, Jie; Iwase, Akihiro; Takasugi, Takayuki

    2017-03-01

    Transformation kinetics and phase equilibrium of metastable and stable precipitates in age-hardenable Cu-4 at. pct Ti binary alloy have been investigated by monitoring the microstructural evolution during isothermal aging at temperatures between 693 K (420 °C) and 973 K (700 °C). The microstructure of the supersaturated solid solution evolves in four stages: compositional modulation due to spinodal decomposition, continuous precipitation of the needle-shaped metastable β'-Cu4Ti with a tetragonal structure, discontinuous precipitation of cellular components containing stable β-Cu4Ti lamellae with an orthorhombic structure, and eventually precipitation saturation at equilibrium. In specimens aged below 923 K (650 °C), the stable β-Cu4Ti phase is produced only due to the cellular reaction, whereas it can be also directly obtained from the intergranular needle-shaped β'-Cu4Ti precipitates in specimens aged at 973 K (700 °C). The precipitation kinetics and phase equilibrium observed for the specimens aged between 693 K (420 °C) and 973 K (700 °C) were characterized in accordance with a time-temperature-transformation (TTT) diagram and a Cu-Ti partial phase diagram, which were utilized to determine the alloy microstructure, strength, and electrical conductivity.

  9. Phenomenological Partial Specific Volumes for G-Quadruplex DNAs

    PubMed Central

    Hellman, Lance M.; Rodgers, David W.; Fried, Michael G.

    2009-01-01

    Accurate partial specific volume (ν̄) values are required for sedimentation velocity and sedimentation equilibrium analyses. For nucleic acids, the estimation of these values is complicated by the fact that ν̄ depends on base composition, secondary structure, solvation and the concentrations and identities of ions in the surrounding buffer. Here we describe sedimentation equilibrium measurements of the apparent isopotential partial specific volume φ′ for two G-quadruplex DNAs and a single-stranded DNA of similar molecular weight and base composition. The G-quadruplex DNAs are a 22 nucleotide fragment of the human telomere consensus sequence and a 27 nucleotide fragment from the human c-myc promoter. The single-stranded DNA is 26 nucleotides long and is designed to have low propensity to form secondary structures. Parallel measurements were made in buffers containing NaCl and in buffers containing KCl, spanning the range 0.09M ≤ [salt] ≤ 2.3M. Limiting values of φ′, extrapolated to [salt] = 0M, were: 22-mer (NaCl-form), 0.525 ± 0.004 mL/g; 22-mer (KCl-form), 0.531 ± 0.006 mL/g; 27-mer (NaCl-form), 0.548 ± 0.005 mL/g; 27-mer (KCl-form), 0.557 ± 0.006 mL/g; 26-mer (NaCl-form), 0.555 ± 0.004 mL/g; 26-mer (KCl-form), 0.564 ± 0.006 mL/g. Small changes in φ′ with [salt] suggest that large changes in counterion association or hydration are unlikely to take place over these concentration ranges. PMID:19238377

  10. Conformational plasticity of DM43, a metalloproteinase inhibitor from Didelphis marsupialis: chemical and pressure-induced equilibrium (un)folding studies.

    PubMed

    Chapeaurouge, Alex; Martins, Samantha M; Holub, Oliver; Rocha, Surza L G; Valente, Richard H; Neves-Ferreira, Ana G C; Ferreira, Sérgio T; Domont, Gilberto B; Perales, Jonas

    2009-10-01

    We have investigated the folding of DM43, a homodimeric metalloproteinase inhibitor isolated from the serum of the South American opossum Didelphis marsupialis. Denaturation of the protein induced by GdnHCl (guanidine hydrochloride) was monitored by extrinsic and intrinsic fluorescence spectroscopy. While the equilibrium (un)folding of DM43 followed by tryptophan fluorescence was well described by a cooperative two-state transition, bis-ANS (4,4'-dianilino-1,1'-binaphthyl-5,5'-disulfonic acid) fluorescence measurements revealed an intensity maximum at the midpoint of the unfolding transition (2 M GdnHCl), indicating a partially folded intermediate state. We further investigated the DM43 intermediate stabilized at 2 M GdnHCl using size exclusion chromatography. This analysis revealed that the folding intermediate can be best described as partially folded DM43 monomers. Thermodynamic analysis of the GdnHCl-induced denaturation of DM43 revealed Gibbs free-energy changes of 13.57 kcal/mol for dimer dissociation and 1.86 kcal/mol for monomer unfolding, pointing to a critical role of dimerization as a determinant of the structure and stability of this protein. In addition, by using hydrostatic pressure (up to 3.5 kbar) we were able to stabilize partially folded states different from those stabilized in the presence of GdnHCl. Taken together, these results indicate that the conformational plasticity of DM43 could provide this protein with the ability to adapt its conformation to a variety of different environments and biological partners during its biological lifetime.

  11. Prediction of hydrodynamics and chemistry of confined turbulent methane-air frames in a two concentric tube combustor

    NASA Technical Reports Server (NTRS)

    Markatos, N. C.; Spalding, D. B.; Srivatsa, S. K.

    1978-01-01

    A formulation of the governing partial differential equations for fluid flow and reacting chemical species in a two-concentric-tube combustor is presented. A numerical procedure for the solution of the governing differential equations is described and models for chemical-equilibrium and chemical-kinetics calculations are presented. The chemical-equilibrium model is used to characterize the hydrocarbon reactions. The chemical-kinetics model is used to predict the concentrations of the oxides of nitrogen. The combustor considered consists of two coaxial ducts. Concentric streams of gaseous fuel and air enter the inlet duct at one end; the flow then reverses and flows out through the outer duct. Two sample cases with specified inlet and boundary conditions are considered and the results are discussed.

  12. Quantum statistical mechanics of dense partially ionized hydrogen.

    NASA Technical Reports Server (NTRS)

    Dewitt, H. E.; Rogers, F. J.

    1972-01-01

    The theory of dense hydrogenic plasmas beginning with the two component quantum grand partition function is reviewed. It is shown that ionization equilibrium and molecular dissociation equilibrium can be treated in the same manner with proper consideration of all two-body states. A quantum perturbation expansion is used to give an accurate calculation of the equation of state of the gas for any degree of dissociation and ionization. In this theory, the effective interaction between any two charges is the dynamic screened potential obtained from the plasma dielectric function. We make the static approximation; and we carry out detailed numerical calculations with the bound and scattering states of the Debye potential, using the Beth-Uhlenbeck form of the quantum second virial coefficient. We compare our results with calculations from the Saha equation.

  13. Equilibrium structures of carbon diamond-like clusters and their elastic properties

    NASA Astrophysics Data System (ADS)

    Lisovenko, D. S.; Baimova, Yu. A.; Rysaeva, L. Kh.; Gorodtsov, V. A.; Dmitriev, S. V.

    2017-04-01

    Three-dimensional carbon diamond-like phases consisting of sp 3-hybridized atoms, obtained by linking of carcasses of fullerene-like molecules, are studied by methods of molecular dynamics modeling. For eight cubic and one hexagonal diamond-like phases on the basis of four types of fullerene-like molecules, equilibrium configurations are found and the elastic constants are calculated. The results obtained by the method of molecular dynamics are used for analytical calculations of the elastic characteristics of the diamond- like phases with the cubic and hexagonal anisotropy. It is found that, for a certain choice of the dilatation axis, three of these phases have negative Poisson's ratio, i.e., are partial auxetics. The variability of the engineering elasticity coefficients (Young's modulus, Poisson's ratio, shear modulus, and bulk modulus) is analyzed.

  14. Folding pathway of the pyridoxal 5′-phosphate C-S lyase MalY from Escherichia coli

    PubMed Central

    2005-01-01

    MalY from Escherichia coli is a bifunctional dimeric PLP (pyridoxal 5′-phosphate) enzyme acting as a β-cystathionase and as a repressor of the maltose system. The spectroscopic and molecular properties of the holoenzyme, in the untreated and NaBH4-treated forms, and of the apoenzyme have been elucidated. A systematic study of the urea-induced unfolding of MalY has been monitored by gel filtration, cross-linking, ANS (8-anilino-1-naphthalenesulphonic acid) binding and by visible, near- and far-UV CD, fluorescence and NMR spectroscopies under equilibrium conditions. Unfolding proceeds in at least three stages. The first transition, occurring between 0 and 1 M urea, gives rise to a partially active dimeric species that binds PLP. The second equilibrium transition involving dimer dissociation, release of PLP and loss of lyase activity leads to the formation of a monomeric equilibrium intermediate. It is a partially unfolded molecule that retains most of the native-state secondary structure, binds significant amounts of ANS (a probe for exposed hydrophobic surfaces) and tends to self-associate. The self-associated aggregates predominate at urea concentrations of 2–4 M for holoMalY. The third step represents the complete unfolding of the enzyme. These results when compared with the urea-induced unfolding profiles of apoMalY and NaBH4-reduced holoenzyme suggest that the coenzyme group attached to the active-site lysine residue increases the stability of the dimeric enzyme. Both holo- and apo-MalY could be successfully refolded into the active enzyme with an 85% yield. Further refolding studies suggest that large misfolded soluble aggregates that cannot be refolded could be responsible for the incomplete re-activation. PMID:15823094

  15. Missile Datcom User’s Manual - 2008 Revision

    DTIC Science & Technology

    2008-08-01

    and Surface Roughness ........................ 58 Table 24. Magnus derivatives calculated with SPIN Control Card...M.F.E. Dillenius (W.B. Blake) WL-TR-91-3039 (ADA 237817) 5 4/91 Inlets at sub/transonic speeds, additive drag Plume effects on body Six types...control card. This control card has no effect on input angles, input angles are always specified in degrees. Partial output results, which detail the

  16. Development and Application of Low Energy X-Ray and Electron Physics.

    DTIC Science & Technology

    1981-01-01

    measured and theoretical photoionization cross section data (including those measured in this laboratory). In 1975, a detailed set of tables of these...available reported (to 1980) experimental and theoretical photoionization cross section data have been compiled and reviewed particularly for the low energy...orbital dimensions, the current theoretical partial photoionization cross section calculations have been applied to yield oscillator densities which permit

  17. Trapped nonneutral plasmas, liquids, and crystals (the thermal equilibrium states)

    NASA Astrophysics Data System (ADS)

    Dubin, Daniel H.; O'neil, T. M.

    1999-01-01

    Plasmas consisting exclusively of particles with a single sign of charge (e.g., pure electron plasmas and pure ion plasmas) can be confined by static electric and magnetic fields (in a Penning trap) and also be in a state of global thermal equilibrium. This important property distinguishes these totally unneutralized plasmas from neutral and quasineutral plasmas. This paper reviews the conditions for, and the structure of, the thermal equilibrium states. Both theory and experiment are discussed, but the emphasis is decidedly on theory. It is a huge advantage to be able to use thermal equilibrium statistical mechanics to describe the plasma state. Such a description is easily obtained and complete, including for example the details of the plasma shape and microscopic order. Pure electron and pure ion plasmas are routinely confined for hours and even days, and thermal equilibrium states are observed. These plasmas can be cooled to the cryogenic temperature range, where liquid and crystal-like states are realized. The authors discuss the structure of the correlated states separately for three plasma sizes: large plasmas, in which the free energy is dominated by the bulk plasma; mesoscale plasmas, in which the free energy is strongly influenced by the surface; and Coulomb clusters, in which the number of particles is so small that the canonical ensemble is not a good approximation for the microcanonical ensemble. All three cases have been studied through numerical simulations, analytic theory, and experiment. In addition to describing the structure of the thermal equilibrium states, the authors develop a thermodynamic theory of the trapped plasma system. Thermodynamic inequalities and Maxwell relations provide useful bounds on and general relationships between partial derivatives of the various thermodynamic variables.

  18. Ecological and toxicological aspects of the partial meltdown of the Chernobyl nuclear power plant reactor

    USGS Publications Warehouse

    Eisler, Ronald; Hoffman, David J.; Rattner, Barnett A.; Burton, G. Allen; Cairns, John

    1995-01-01

    the partial meltdown of the 1000-MW reactor at Chernobyl, Ukraine, on April 26, 1986, released large amounts of radiocesium and other radionuclides into the environment, causing widespread radioactive contamination of Europe and the former Soviet Union.1-7 At least 3,000,000 trillion becquerels (TBq) were released from the fuel during the accident (Table 24.1), dwarfing, by orders of magnitude, radiation released from other highly publicized reactor accidents at Windscale (U.K.) and three-Mile Island (U.S.)3,8 The Chernobyl accident happened while a test was being conducted during a normal scheduled shutdown and is attributed mainly to human error.3

  19. Self-Organization of Blood Pressure Regulation: Experimental Evidence

    PubMed Central

    Fortrat, Jacques-Olivier; Levrard, Thibaud; Courcinous, Sandrine; Victor, Jacques

    2016-01-01

    Blood pressure regulation is a prime example of homeostatic regulation. However, some characteristics of the cardiovascular system better match a non-linear self-organized system than a homeostatic one. To determine whether blood pressure regulation is self-organized, we repeated the seminal demonstration of self-organized control of movement, but applied it to the cardiovascular system. We looked for two distinctive features peculiar to self-organization: non-equilibrium phase transitions and hysteresis in their occurrence when the system is challenged. We challenged the cardiovascular system by means of slow, 20-min Tilt-Up and Tilt-Down tilt table tests in random order. We continuously determined the phase between oscillations at the breathing frequency of Total Peripheral Resistances and Heart Rate Variability by means of cross-spectral analysis. We looked for a significant phase drift during these procedures, which signed a non-equilibrium phase transition. We determined at which head-up tilt angle it occurred. We checked that this angle was significantly different between Tilt-Up and Tilt-Down to demonstrate hysteresis. We observed a significant non-equilibrium phase transition in nine healthy volunteers out of 11 with significant hysteresis (48.1 ± 7.5° and 21.8 ± 3.9° during Tilt-Up and Tilt-Down, respectively, p < 0.05). Our study shows experimental evidence of self-organized short-term blood pressure regulation. It provides new insights into blood pressure regulation and its related disorders. PMID:27065880

  20. Equilibrium chemistry down to 100 K. Impact of silicates and phyllosilicates on the carbon to oxygen ratio

    NASA Astrophysics Data System (ADS)

    Woitke, P.; Helling, Ch.; Hunter, G. H.; Millard, J. D.; Turner, G. E.; Worters, M.; Blecic, J.; Stock, J. W.

    2018-06-01

    We have introduced a fast and versatile computer code, GGCHEM, to determine the chemical composition of gases in thermo-chemical equilibrium down to 100 K, with or without equilibrium condensation. We have reviewed the data for molecular equilibrium constants, kp(T), from several sources and discussed which functional fits are most suitable for low temperatures. We benchmarked our results against another chemical equilibrium code. We collected Gibbs free energies, ΔGf⊖, for about 200 solid and liquid species from the NIST-JANAF database and the geophysical database SUPCRTBL. We discussed the condensation sequence of the elements with solar abundances in phase equilibrium down to 100 K. Once the major magnesium silicates Mg2SiO4[s] and MgSiO3[s] have formed, the dust to gas mass ratio jumps to a value of about 0.0045 which is significantly lower than the often assumed value of 0.01. Silicate condensation is found to increase the carbon to oxygen ratio (C/O) in the gas from its solar value of 0.55 up to 0.71, and, by the additional intake of water and hydroxyl into the solid matrix, the formation of phyllosilicates at temperatures below 400 K increases the gaseous C/O further to about 0.83. Metallic tungsten (W) is the first condensate found to become thermodynamically stable around 1600-2200 K (depending on pressure), several hundreds of Kelvin before subsequent materials such as zirconium dioxide (ZrO2) or corundum (Al2O3) can condense. We briefly discuss whether tungsten, despite its low abundance of 2 × 10-7 times the silicon abundance, could provide the first seed particles for astrophysical dust formation. GGCHEM code is publicly available at http://https://github.com/pw31/GGchemTable D.1 is only available at the CDS via anonymous ftp to http://cdsarc.u-strasbg.fr (http://130.79.128.5) or via http://cdsarc.u-strasbg.fr/viz-bin/qcat?J/A+A/614/A1

  1. Human Health Countermeasures - Partial-Gravity Analogs Workshop

    NASA Technical Reports Server (NTRS)

    Barr, Yael; Clement, Gilles; Norsk, Peter

    2016-01-01

    The experimental conditions that were deemed the most interesting by the HHC Element lead scientists are those permitting studies of the long-term effects of exposure to (a) chronic rotation when supine or in head down tilt (ground-based); and (b) long-radius centrifugation (space based). It is interesting to note that chronic ground based slow rotation room studies have not been performed since the 1960's, when the USA and USSR were investigating the potential use of AG for long-duration space missions. On the other hand, the other partial gravity analogs, i.e., parabolic flight, HUT, suspension, and short-radius centrifugation, have been regularly used in the last three decades (see review in Clément et al. 2015). Based on the workshop evaluations and the scores by the HHC scientific disciplines indicated in tables 3 and 4, simulation of partial G between 0 and 1 should be prioritized as follows: Priority 1. Chronic space-based partial-G analogs: a. Chronic space-based long-radius centrifugation. The ideal scenario would be chronic long-radius centrifugation of cells, animals and humans in a translational research approach - ideally beyond low earth orbit under deep space environmental effects and at various rotations - to obtain different G-effects. In this scenario, all physiological systems could be evaluated and the relationship between physiological response and G level established. This would be the most integrative way of defining, for the first time ever, G-thresholds for each physiological system. b. Chronic space-based centrifugation of animals. Chronic centrifugation of rodents at various G levels in space would allow for determination of AG thresholds of protection for each physiological system. In this case, all physiological systems will be of interest. Intermittent centrifugation will be of secondary interest. c. Chronic space-based centrifugation of cell cultures (RWV). Bioreactor studies of cells and cell cultures of various tissues at various G levels would allow for intracellular investigations of the effects of partial-G. Priority 2. Acute, intermittent space based partial-G analogs: a. Acute, intermittent space-based short radius human centrifugation. Intermittent centrifugation of humans would allow determination of thresholds of AG for protection of astronaut health in space. Priority 3. Chronic ground-based partial-G analogs: a. Chronic centrifugation of supine or head-down tilted humans. b. Chronic head-up tilt in humans. c. Chronic head-out graded dry immersion in humans. d. Chronic partial suspension of rodents e. Chronic rotating bioreactor cell culture studies (RWV) Priority 4. Acute ground based partial-G analogs. a. Parabolic flights. Very acute and short term effects of G levels between 0 and 1 in humans for fast responding systems like cardiovascular and sensorimotor as well as for acute responses in cell cultures and animals. b. Other acute models as indicated in table 3.

  2. Formation and Dimerization of NO2 A General Chemistry Experiment

    NASA Astrophysics Data System (ADS)

    Hennis, April D.; Highberger, C. Scott; Schreiner, Serge

    1997-11-01

    We have developed a general chemistry experiment which illustrates Gay-Lussac's law of combining volumes. Students are able to determine the partial pressures and equilibrium constant for the formation and dimerization of NO2. The experiment can be carried out in about 45 minutes with students working in groups of two. The experiment readily provides students with data that can be manipulated with a common spreadsheet.

  3. Predictions for partial and monolayer coverages of O2 on graphite

    NASA Technical Reports Server (NTRS)

    Pan, R. P.; Etters, R. D.; Kobashi, K.; Chandrasekharan, V.

    1982-01-01

    Monolayer properties of O2 on graphite are calculated using a pattern recognition, optimization scheme. Equilibrium monolayers are predicted at two different densities with properties in agreement with recent X-ray diffraction, specific heat, and neutron scattering data. Properties of the extremely low density regime are calculated using a model based upon a distribution of two-dimensional O2 clusters. The results are consistent with experimental evidence.

  4. Effects of Processing on MOS Radiation Hardening

    DTIC Science & Technology

    1992-09-01

    magnitude) impurity inclusion for Fluorine sources vs. Chlorine sources, many of the other beneficial effects on point defects, traps, MOS quality, etc...profiles. The addition of percent concentrations of a chlorine rates from 1 to 10 ml/nmr. This corresponded to fluorine bearing compound to the silicon...computes the partial roethane and gaseous nitrogen trifluoride . The alphatic liq- pres-ures of all the possible species in equilibrium in the uid

  5. Multi-fluid Modeling of Magnetosonic Wave Propagation in the Solar Chromosphere: Effects of Impact Ionization and Radiative Recombination

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Maneva, Yana G.; Laguna, Alejandro Alvarez; Poedts, Stefaan

    2017-02-20

    In order to study chromospheric magnetosonic wave propagation including, for the first time, the effects of ion–neutral interactions in the partially ionized solar chromosphere, we have developed a new multi-fluid computational model accounting for ionization and recombination reactions in gravitationally stratified magnetized collisional media. The two-fluid model used in our 2D numerical simulations treats neutrals as a separate fluid and considers charged species (electrons and ions) within the resistive MHD approach with Coulomb collisions and anisotropic heat flux determined by Braginskiis transport coefficients. The electromagnetic fields are evolved according to the full Maxwell equations and the solenoidality of the magneticmore » field is enforced with a hyperbolic divergence-cleaning scheme. The initial density and temperature profiles are similar to VAL III chromospheric model in which dynamical, thermal, and chemical equilibrium are considered to ensure comparison to existing MHD models and avoid artificial numerical heating. In this initial setup we include simple homogeneous flux tube magnetic field configuration and an external photospheric velocity driver to simulate the propagation of MHD waves in the partially ionized reactive chromosphere. In particular, we investigate the loss of chemical equilibrium and the plasma heating related to the steepening of fast magnetosonic wave fronts in the gravitationally stratified medium.« less

  6. Effect of Group-III precursors on unintentional gallium incorporation during epitaxial growth of InAlN layers by metalorganic chemical vapor deposition

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Kim, Jeomoh, E-mail: jkim610@gatech.edu; Ji, Mi-Hee; Detchprohm, Theeradetch

    2015-09-28

    Unintentional incorporation of gallium (Ga) in InAlN layers grown with different molar flow rates of Group-III precursors by metalorganic chemical vapor deposition has been experimentally investigated. The Ga mole fraction in the InAl(Ga)N layer was increased significantly with the trimethylindium (TMIn) flow rate, while the trimethylaluminum flow rate controls the Al mole fraction. The evaporation of metallic Ga from the liquid phase eutectic system between the pyrolized In from injected TMIn and pre-deposited metallic Ga was responsible for the Ga auto-incorporation into the InAl(Ga)N layer. The theoretical calculation on the equilibrium vapor pressure of liquid phase Ga and the effectivemore » partial pressure of Group-III precursors based on growth parameters used in this study confirms the influence of Group-III precursors on Ga auto-incorporation. More Ga atoms can be evaporated from the liquid phase Ga on the surrounding surfaces in the growth chamber and then significant Ga auto-incorporation can occur due to the high equilibrium vapor pressure of Ga comparable to effective partial pressure of input Group-III precursors during the growth of InAl(Ga)N layer.« less

  7. ORTHO-TO-PARA RATIO STUDIES OF SHOCKED H{sub 2} GAS IN THE TWO SUPERNOVA REMNANTS IC 443 AND HB 21

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Shinn, Jong-Ho; Moon, Dae-Sik; Lee, Ho-Gyu, E-mail: jhshinn@kasi.re.kr, E-mail: hglee@astron.s.u-tokyo.ac.jp, E-mail: moon@astro.utoronto.ca

    2012-11-01

    We present near-infrared (2.5-5.0 {mu}m) spectral studies of shocked H{sub 2} gas in two supernova remnants, IC 443 and HB 21, which are well known for their interactions with nearby molecular clouds. The observations were performed with the Infrared Camera aboard the AKARI satellite. At the energy range 7000 K {approx}< E({upsilon},J) {approx}< 20,000 K, the shocked H{sub 2} gas in IC 443 shows an ortho-to-para ratio (OPR) of 2.4{sup +0.3} {sub -0.2}, which is significantly lower than the equilibrium value 3, suggesting the existence of non-equilibrium OPR. The shocked gas in HB 21 also indicates a potential non-equilibrium OPRmore » in the range of 1.8-2.0. The level populations are well described by the power-law thermal admixture model with a single OPR, where the temperature integration range is 1000-4000 K. We conclude that the obtained non-equilibrium OPR probably originates from the reformed H{sub 2} gas of dissociative J-shocks, considering several factors such as the shock combination requirement, the line ratios, and the possibility that H{sub 2} gas can form on grains with a non-equilibrium OPR. We also investigate C-shocks and partially dissociative J-shocks as the origin of the non-equilibrium OPR. However, we find that they are incompatible with the observed ionic emission lines for which dissociative J-shocks are required to explain. The difference in the collision energy of H atoms on grain surfaces would give rise to the observed difference between the OPRs of IC 443 and HB 21, if dissociative J-shocks are responsible for the H{sub 2} emission. Our study suggests that dissociative J-shocks can produce shocked H{sub 2} gas with a non-equilibrium OPR.« less

  8. Implementation of a Goal-Directed Mechanical Ventilation Order Set Driven by Respiratory Therapists Improves Compliance With Best Practices for Mechanical Ventilation.

    PubMed

    Radosevich, Misty A; Wanta, Brendan T; Meyer, Todd J; Weber, Verlin W; Brown, Daniel R; Smischney, Nathan J; Diedrich, Daniel A

    2017-01-01

    Data regarding best practices for ventilator management strategies that improve outcomes in acute respiratory distress syndrome (ARDS) are readily available. However, little is known regarding processes to ensure compliance with these strategies. We developed a goal-directed mechanical ventilation order set that included physician-specified lung-protective ventilation and oxygenation goals to be implemented by respiratory therapists (RTs). We sought as a primary outcome to determine whether an RT-driven order set with predefined oxygenation and ventilation goals could be implemented and associated with improved adherence with best practice. We evaluated 1302 patients undergoing invasive mechanical ventilation (1693 separate episodes of invasive mechanical ventilation) prior to and after institution of a standardized, goal-directed mechanical ventilation order set using a controlled before-and-after study design. Patient-specific goals for oxygenation partial pressure of oxygen in arterial blood (Pao 2 ), ARDS Network [Net] positive end-expiratory pressure [PEEP]/fraction of inspired oxygen [Fio 2 ] table use) and ventilation (pH, partial pressure of carbon dioxide) were selected by prescribers and implemented by RTs. Compliance with the new mechanical ventilation order set was high: 88.2% compliance versus 3.8% before implementation of the order set ( P < .001). Adherence to the PEEP/Fio 2 table after implementation of the order set was significantly greater (86.0% after vs 82.9% before, P = .02). There was no difference in duration of mechanical ventilation, intensive care unit (ICU) length of stay, and in-hospital or ICU mortality. A standardized best practice mechanical ventilation order set can be implemented by a multidisciplinary team and is associated with improved compliance to written orders and adherence to the ARDSNet PEEP/Fio 2 table.

  9. Equation-of-State Scaling Factors

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Scannapieco, Anthony J.

    2016-06-28

    Equation-of-State scaling factors are needed when using a tabular EOS in which the user de ned material isotopic fractions di er from the actual isotopic fractions used by the table. Additionally, if a material is dynamically changing its isotopic structure, then an EOS scaling will again be needed, and will vary in time and location. The procedure that allows use of a table to obtain information about a similar material with average atomic mass Ms and average atomic number Zs is described below. The procedure is exact for a fully ionized ideal gas. However, if the atomic number is replacemore » by the e ective ionization state the procedure can be applied to partially ionized material as well, which extends the applicability of the scaling approximation continuously from low to high temperatures.« less

  10. Estimated Depth to Ground Water and Configuration of the Water Table in the Portland, Oregon Area

    USGS Publications Warehouse

    Snyder, Daniel T.

    2008-01-01

    Reliable information on the configuration of the water table in the Portland metropolitan area is needed to address concerns about various water-resource issues, especially with regard to potential effects from stormwater injection systems such as UIC (underground injection control) systems that are either existing or planned. To help address these concerns, this report presents the estimated depth-to-water and water-table elevation maps for the Portland area, along with estimates of the relative uncertainty of the maps and seasonal water-table fluctuations. The method of analysis used to determine the water-table configuration in the Portland area relied on water-level data from shallow wells and surface-water features that are representative of the water table. However, the largest source of available well data is water-level measurements in reports filed by well constructors at the time of new well installation, but these data frequently were not representative of static water-level conditions. Depth-to-water measurements reported in well-construction records generally were shallower than measurements by the U.S. Geological Survey (USGS) in the same or nearby wells, although many depth-to-water measurements were substantially deeper than USGS measurements. Magnitudes of differences in depth-to-water measurements reported in well records and those measured by the USGS in the same or nearby wells ranged from -119 to 156 feet with a mean of the absolute value of the differences of 36 feet. One possible cause for the differences is that water levels in many wells reported in well records were not at equilibrium at the time of measurement. As a result, the analysis of the water-table configuration relied on water levels measured during the current study or used in previous USGS investigations in the Portland area. Because of the scarcity of well data in some areas, the locations of select surface-water features including major rivers, streams, lakes, wetlands, and springs representative of where the water table is at land surface were used to augment the analysis. Ground-water and surface-water data were combined for use in interpolation of the water-table configuration. Interpolation of the two representations typically used to define water-table position - depth to the water table below land surface and elevation of the water table above a datum - can produce substantially different results and may represent the end members of a spectrum of possible interpolations largely determined by the quantity of recharge and the hydraulic properties of the aquifer. Datasets of depth-to-water and water-table elevation for the current study were interpolated independently based on kriging as the method of interpolation with parameters determined through the use of semivariograms developed individually for each dataset. Resulting interpolations were then combined to create a single, averaged representation of the water-table configuration. Kriging analysis also was used to develop a map of relative uncertainty associated with the values of the water-table position. Accuracy of the depth-to-water and water-table elevation maps is dependent on various factors and assumptions pertaining to the data, the method of interpolation, and the hydrogeologic conditions of the surficial aquifers in the study area. Although the water-table configuration maps generally are representative of the conditions in the study area, the actual position of the water-table may differ from the estimated position at site-specific locations, and short-term, seasonal, and long-term variations in the differences also can be expected. The relative uncertainty map addresses some but not all possible errors associated with the analysis of the water-table configuration and does not depict all sources of uncertainty. Depth to water greater than 300 feet in the Portland area is limited to parts of the Tualatin Mountains, the foothills of the Cascade Range, and muc

  11. HELIOS: An Open-source, GPU-accelerated Radiative Transfer Code for Self-consistent Exoplanetary Atmospheres

    NASA Astrophysics Data System (ADS)

    Malik, Matej; Grosheintz, Luc; Mendonça, João M.; Grimm, Simon L.; Lavie, Baptiste; Kitzmann, Daniel; Tsai, Shang-Min; Burrows, Adam; Kreidberg, Laura; Bedell, Megan; Bean, Jacob L.; Stevenson, Kevin B.; Heng, Kevin

    2017-02-01

    We present the open-source radiative transfer code named HELIOS, which is constructed for studying exoplanetary atmospheres. In its initial version, the model atmospheres of HELIOS are one-dimensional and plane-parallel, and the equation of radiative transfer is solved in the two-stream approximation with nonisotropic scattering. A small set of the main infrared absorbers is employed, computed with the opacity calculator HELIOS-K and combined using a correlated-k approximation. The molecular abundances originate from validated analytical formulae for equilibrium chemistry. We compare HELIOS with the work of Miller-Ricci & Fortney using a model of GJ 1214b, and perform several tests, where we find: model atmospheres with single-temperature layers struggle to converge to radiative equilibrium; k-distribution tables constructed with ≳ 0.01 cm-1 resolution in the opacity function (≲ {10}3 points per wavenumber bin) may result in errors ≳ 1%-10% in the synthetic spectra; and a diffusivity factor of 2 approximates well the exact radiative transfer solution in the limit of pure absorption. We construct “null-hypothesis” models (chemical equilibrium, radiative equilibrium, and solar elemental abundances) for six hot Jupiters. We find that the dayside emission spectra of HD 189733b and WASP-43b are consistent with the null hypothesis, while the latter consistently underpredicts the observed fluxes of WASP-8b, WASP-12b, WASP-14b, and WASP-33b. We demonstrate that our results are somewhat insensitive to the choice of stellar models (blackbody, Kurucz, or PHOENIX) and metallicity, but are strongly affected by higher carbon-to-oxygen ratios. The code is publicly available as part of the Exoclimes Simulation Platform (exoclime.net).

  12. Dynamic wetting and spreading and the role of topography.

    PubMed

    McHale, Glen; Newton, Michael I; Shirtcliffe, Neil J

    2009-11-18

    The spreading of a droplet of a liquid on a smooth solid surface is often described by the Hoffman-de Gennes law, which relates the edge speed, v(e), to the dynamic and equilibrium contact angles θ and θ(e) through [Formula: see text]. When the liquid wets the surface completely and the equilibrium contact angle vanishes, the edge speed is proportional to the cube of the dynamic contact angle. When the droplets are non-volatile this law gives rise to simple power laws with time for the contact angle and other parameters in both the capillary and gravity dominated regimes. On a textured surface, the equilibrium state of a droplet is strongly modified due to the amplification of the surface chemistry induced tendencies by the topography. The most common example is the conversion of hydrophobicity into superhydrophobicity. However, when the surface chemistry favors partial wetting, topography can result in a droplet spreading completely. A further, frequently overlooked consequence of topography is that the rate at which an out-of-equilibrium droplet spreads should also be modified. In this report, we review ideas related to the idea of topography induced wetting and consider how this may relate to dynamic wetting and the rate of droplet spreading. We consider the effect of the Wenzel and Cassie-Baxter equations on the driving forces and discuss how these may modify power laws for spreading. We relate the ideas to both the hydrodynamic viscous dissipation model and the molecular-kinetic theory of spreading. This suggests roughness and solid surface fraction modified Hoffman-de Gennes laws relating the edge speed to the dynamic and equilibrium contact angle. We also consider the spreading of small droplets and stripes of non-volatile liquids in the capillary regime and large droplets in the gravity regime. In the case of small non-volatile droplets spreading completely, a roughness modified Tanner's law giving the dependence of dynamic contact angle on time is presented. We review existing data for the spreading of small droplets of polydimethylsiloxane oil on surfaces decorated with micro-posts. On these surfaces, the initial droplet spreads with an approximately constant volume and the edge speed-dynamic contact angle relationship follows a power law [Formula: see text]. As the surface texture becomes stronger the exponent goes from p = 3 towards p = 1 in agreement with a Wenzel roughness driven spreading and a roughness modified Hoffman-de Gennes power law. Finally, we suggest that when a droplet spreads to a final partial wetting state on a rough surface, it approaches its Wenzel equilibrium contact angle in an exponential manner with a time constant dependent on roughness.

  13. Empirical model for calculating vapor-liquid equilibrium and associated phase enthalpy for the CO$sub 2$--O$sub 2$--Kr--Xe system for application to the KALC process

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Glass, R. W.; Gilliam, T. M.; Fowler, V. L.

    An empirical model is presented for vapor-liquid equilibria and enthalpy for the CO$sub 2$-O$sub 2$ system. In the model, krypton and xenon in very low concentrations are combined with the CO$sub 2$-O$sub 2$ system, thereby representing the total system of primary interest in the High-Temperature Gas- Cooled Reactor program for removing krypton from off-gas generated during the reprocessing of spent fuel. Selected properties of the individual and combined components being considered are presented in the form of tables and empirical equations. (auth)

  14. Standard electrode potentials involving radicals in aqueous solution: inorganic radicals (IUPAC Technical Report)

    DOE PAGES

    Armstrong, David A.; Huie, Robert E.; Koppenol, Willem H.; ...

    2015-01-01

    We made recommendations for standard potentials involving select inorganic radicals in aqueous solution at 25 °C. These recommendations are based on a critical and thorough literature review and also by performing derivations from various literature reports. We also summarized the data in tables of standard potentials, Gibbs energies of formation, radical pKa’s, and hemicolligation equilibrium constants. In all cases, current best estimates of the uncertainties are provided. An extensive set of Data Sheets is appended that provide original literature references, summarize the experimental results, and describe the decisions and procedures leading to each of the recommendations.

  15. Chemistry in interstellar space. [environment characteristics influencing reaction dynamics

    NASA Technical Reports Server (NTRS)

    Donn, B.

    1973-01-01

    The particular characteristics of chemistry in interstellar space are determined by the unique environmental conditions involved. Interstellar matter is present at extremely low densities. Large deviations from thermodynamic equilibrium are, therefore, to be expected. A relatively intense ultraviolet radiation is present in many regions. The temperatures are in the range from 5 to 200 K. Data concerning the inhibiting effect of small activation energies in interstellar clouds are presented in a table. A summary of measured activation energies or barrier heights for exothermic exchange reactions is also provided. Problems of molecule formation are discussed, taking into account gas phase reactions and surface catalyzed processes.

  16. Distribution of nuclei in equilibrium stellar matter from the free-energy density in a Wigner-Seitz cell

    NASA Astrophysics Data System (ADS)

    Grams, G.; Giraud, S.; Fantina, A. F.; Gulminelli, F.

    2018-03-01

    The aim of the present study is to calculate the nuclear distribution associated at finite temperature to any given equation of state of stellar matter based on the Wigner-Seitz approximation, for direct applications in core-collapse simulations. The Gibbs free energy of the different configurations is explicitly calculated, with special care devoted to the calculation of rearrangement terms, ensuring thermodynamic consistency. The formalism is illustrated with two different applications. First, we work out the nuclear statistical equilibrium cluster distribution for the Lattimer and Swesty equation of state, widely employed in supernova simulations. Secondly, we explore the effect of including shell structure, and consider realistic nuclear mass tables from the Brussels-Montreal Hartree-Fock-Bogoliubov model (specifically, HFB-24). We show that the whole collapse trajectory is dominated by magic nuclei, with extremely spread and even bimodal distributions of the cluster probability around magic numbers, demonstrating the importance of cluster distributions with realistic mass models in core-collapse simulations. Simple analytical expressions are given, allowing further applications of the method to any relativistic or nonrelativistic subsaturation equation of state.

  17. Combat Medical Modernization: Posturing Low Supply And High Demand Assets To Meet Emerging And Future Capability Requirements

    DTIC Science & Technology

    2015-07-01

    OFFICE OF THE AIR FORCE SURGEON GENERAL FELLOWSHIP PAPER COMBAT MEDICAL MODERNIZATION: POSTURING LOW SUPPLY AND HIGH DEMAND ASSETS TO...Maj, USAF, MSC Scott A. Baker, Capt, USAF, MSC A Research Report Submitted to HQ AF/SG35X In Partial Fulfillment of Medical Plans Fellowship...i TABLE OF FIGURES 3 I. INTRODUCTION 5 II. CURRENT MEDICAL EN-ROUTE CARE CAPABILITY

  18. VINE: A Variational Inference -Based Bayesian Neural Network Engine

    DTIC Science & Technology

    2018-01-01

    networks are trained using the same dataset and hyper parameter settings as discussed. Table 1 Performance evaluation of the proposed transfer learning...multiplication/addition/subtraction. These operations can be implemented using nested loops in which various iterations of a loop are independent of...each other. This introduces an opportunity for optimization where a loop may be unrolled fully or partially to increase parallelism at the cost of

  19. Exercise Adherence in Persons with Type 2 Diabetes and Relationship to Diabetes Control.

    DTIC Science & Technology

    1997-01-01

    peripheral neuropathy, and 4 (20%) reported having 29 retinopathy (see Table 8). No significance across the stages or between exercisers and non...Physical exercise rehabilitation : long-term dropout rate in cardiac patients. Journal of Behvioral Medicine 3. 163-168. Courneya. K.S. & McAuley... EXERCISE ADHERENCE IN PERSONS WITH TYPE 2 DIABETES AND RELATIONSHD? TO DIABETES CONTROL by SARAH S. FERGUSON A thesis submitted in partial

  20. Emission Rates of Volatile Organic Compounds Released from Newly Produced Household Furniture Products Using a Large-Scale Chamber Testing Method

    PubMed Central

    Ho, Duy Xuan; Kim, Ki-Hyun; Ryeul Sohn, Jong; Hee Oh, Youn; Ahn, Ji-Won

    2011-01-01

    The emission rates of volatile organic compounds (VOCs) were measured to investigate the emission characteristics of five types of common furniture products using a 5 m3 size chamber at 25°C and 50% humidity. The results indicated that toluene and α-pinene are the most dominant components. The emission rates of individual components decreased constantly through time, approaching the equilibrium emission level. The relative ordering of their emission rates, if assessed in terms of total VOC (TVOC), can be arranged as follows: dining table > sofa > desk chair > bedside table > cabinet. If the emission rates of VOCs are examined between different chemical groups, they can also be arranged in the following order: aromatic (AR) > terpenes (TER) > carbonyl (CBN) > others > paraffin (PR) > olefin (HOL) > halogenated paraffin (HPR). In addition, if emission strengths are compared between coated and uncoated furniture, there is no significant difference in terms of emission magnitude. Our results indicate that the emission characteristics of VOC are greatly distinguished between different furniture products in terms of relative dominance between different chemicals. PMID:22125421

  1. Estimation of Stresses in a Dry Sand Layer Tested on Shaking Table

    NASA Astrophysics Data System (ADS)

    Sawicki, Andrzej; Kulczykowski, Marek; Jankowski, Robert

    2012-12-01

    Theoretical analysis of shaking table experiments, simulating earthquake response of a dry sand layer, is presented. The aim of such experiments is to study seismic-induced compaction of soil and resulting settlements. In order to determine the soil compaction, the cyclic stresses and strains should be calculated first. These stresses are caused by the cyclic horizontal acceleration at the base of soil layer, so it is important to determine the stress field as function of the base acceleration. It is particularly important for a proper interpretation of shaking table tests, where the base acceleration is controlled but the stresses are hard to measure, and they can only be deduced. Preliminary experiments have shown that small accelerations do not lead to essential settlements, whilst large accelerations cause some phenomena typical for limit states, including a visible appearance of slip lines. All these problems should be well understood for rational planning of experiments. The analysis of these problems is presented in this paper. First, some heuristic considerations about the dynamics of experimental system are presented. Then, the analysis of boundary conditions, expressed as resultants of respective stresses is shown. A particular form of boundary conditions has been chosen, which satisfies the macroscopic boundary conditions and the equilibrium equations. Then, some considerations are presented in order to obtain statically admissible stress field, which does not exceed the Coulomb-Mohr yield conditions. Such an approach leads to determination of the limit base accelerations, which do not cause the plastic state in soil. It was shown that larger accelerations lead to increase of the lateral stresses, and the respective method, which may replace complex plasticity analyses, is proposed. It is shown that it is the lateral stress coefficient K0 that controls the statically admissible stress field during the shaking table experiments.

  2. Effect of surface on the dissociation of perfect dislocations into Shockley partials describing the herringbone Au(1\\xA01\\xA01) surface reconstruction

    NASA Astrophysics Data System (ADS)

    Ait-Oubba, A.; Coupeau, C.; Durinck, J.; Talea, M.; Grilhé, J.

    2018-06-01

    In the framework of the continuum elastic theory, the equilibrium positions of Shockley partial dislocations have been determined as a function of their distance from the free surface. It is found that the dissociation width decreases with the decreasing depth, except for a depth range very close to the free surface for which the dissociation width is enlarged. A similar behaviour is also predicted when Shockley dislocation pairs are regularly arranged, whatever the wavelength. These results derived from the elastic theory are compared to STM observations of the reconstructed (1 1 1) surface in gold, which is usually described by a Shockley dislocations network.

  3. Kinetics of wet sodium vapor complex plasma

    NASA Astrophysics Data System (ADS)

    Mishra, S. K.; Sodha, M. S.

    2014-04-01

    In this paper, we have investigated the kinetics of wet (partially condensed) Sodium vapor, which comprises of electrons, ions, neutral atoms, and Sodium droplets (i) in thermal equilibrium and (ii) when irradiated by light. The formulation includes the balance of charge over the droplets, number balance of the plasma constituents, and energy balance of the electrons. In order to evaluate the droplet charge, a phenomenon for de-charging of the droplets, viz., evaporation of positive Sodium ions from the surface has been considered in addition to electron emission and electron/ion accretion. The analysis has been utilized to evaluate the steady state parameters of such complex plasmas (i) in thermal equilibrium and (ii) when irradiated; the results have been graphically illustrated. As a significant outcome irradiated, Sodium droplets are seen to acquire large positive potential, with consequent enhancement in the electron density.

  4. Le Chatelier Principle for Out-of-Equilibrium and Boundary-Driven Systems: Application to Dynamical Phase Transitions.

    PubMed

    Shpielberg, O; Akkermans, E

    2016-06-17

    A stability analysis is presented for boundary-driven and out-of-equilibrium systems in the framework of the hydrodynamic macroscopic fluctuation theory. A Hamiltonian description is proposed which allows us to thermodynamically interpret the additivity principle. A necessary and sufficient condition for the validity of the additivity principle is obtained as an extension of the Le Chatelier principle. These stability conditions result from a diagonal quadratic form obtained using the cumulant generating function. This approach allows us to provide a proof for the stability of the weakly asymmetric exclusion process and to reduce the search for stability to the solution of two coupled linear ordinary differential equations instead of nonlinear partial differential equations. Additional potential applications of these results are discussed in the realm of classical and quantum systems.

  5. Le Chatelier Principle for Out-of-Equilibrium and Boundary-Driven Systems: Application to Dynamical Phase Transitions

    NASA Astrophysics Data System (ADS)

    Shpielberg, O.; Akkermans, E.

    2016-06-01

    A stability analysis is presented for boundary-driven and out-of-equilibrium systems in the framework of the hydrodynamic macroscopic fluctuation theory. A Hamiltonian description is proposed which allows us to thermodynamically interpret the additivity principle. A necessary and sufficient condition for the validity of the additivity principle is obtained as an extension of the Le Chatelier principle. These stability conditions result from a diagonal quadratic form obtained using the cumulant generating function. This approach allows us to provide a proof for the stability of the weakly asymmetric exclusion process and to reduce the search for stability to the solution of two coupled linear ordinary differential equations instead of nonlinear partial differential equations. Additional potential applications of these results are discussed in the realm of classical and quantum systems.

  6. Modeling and Uncertainty Quantification of Vapor Sorption and Diffusion in Heterogeneous Polymers

    DOE PAGES

    Sun, Yunwei; Harley, Stephen J.; Glascoe, Elizabeth A.

    2015-08-13

    A high-fidelity model of kinetic and equilibrium sorption and diffusion is developed and exercised. The gas-diffusion model is coupled with a triple-sorption mechanism: Henry’s law absorption, Langmuir adsorption, and pooling or clustering of molecules at higher partial pressures. Sorption experiments are conducted and span a range of relative humidities (0-95%) and temperatures (30-60°C). Kinetic and equilibrium sorption properties and effective diffusivity are determined by minimizing the absolute difference between measured and modeled uptakes. Uncertainty quantification and sensitivity analysis methods are described and exercised herein to demonstrate the capability of this modeling approach. Water uptake in silica-filled and unfilled poly(dimethylsiloxane) networksmore » is investigated; however, the model is versatile enough to be used with a wide range of materials and vapors.« less

  7. Physical properties of the stratospheric aerosols

    NASA Technical Reports Server (NTRS)

    Toon, O. B.; Pollack, J. B.

    1973-01-01

    A comparison of the equilibrium vapor pressure over nitric acid solutions with observed water and nitric acid partial pressures in the stratosphere implies that nitric acid cannot be present as an aerosol particle in the lower stratosphere. A similar comparison for sulfuric acid solutions indicates that sulfuric acid aerosol particles are 75% H2SO4 by weight in water, in good agreement with direct observations. The freezing curve of H2SO4 solutions requires that the H2SO4 aerosol particles be solid or supercooled. The equilibrium vapor pressure of H2SO4 in the stratosphere is of the order of 20 picotorr. At stratospheric temperatures, ammonium sulfate is in a ferroelectric phase. As a result, polar molecules may form a surface coating on these aerosols, which may be a fertile ground for further chemical reaction.

  8. Is EETA79001 Lithology B A True Melt Composition?

    NASA Technical Reports Server (NTRS)

    Arauza, S. J.; Jones, John H.; Mittlefehldt, D. W.; Le, L.

    2010-01-01

    EETA79001 is a member of the SNC (shergottite, nakhlite, chassignite) group of Martian meteorites. Most SNC meteorites are cumulates or partial cumulates [1] inhibiting calculation of parent magma compositions; only two (QUE94201 and Y- 980459) have been previously identified as true melt compositions. The goal of this study is to test whether EETA79001-B may also represent an equilibrium melt composition, which could potentially expand the current understanding of martian petrology.

  9. Cobalt and scandium partitioning versus iron content for crystalline phases in ultramafic nodules

    USGS Publications Warehouse

    Glassley, W.E.; Piper, D.Z.

    1978-01-01

    Fractionation of Co and Sc between garnets, olivines, and clino- and orthopyroxenes, separated from a suite of Salt Lake Crater ultramafic nodules that equilibrated at the same T and P, is strongly dependent on Fe contents. This observation suggests that petrogenetic equilibrium models of partial melting and crystal fractionation must take into account effects of magma composition, if they are to describe quantitatively geochemical evolutionary trends. ?? 1978.

  10. Metastable superheated ice in liquid-water inclusions under high negative pressure

    USGS Publications Warehouse

    Roedder, E.

    1967-01-01

    In some microscopic inclusions (consisting of aqueous liquid and vapor) in minerals, freezing eliminates the vapor phase because of greater volume occupied by the resulting ice. When vapor fails to nucleate again on partial melting, the resulting negative pressure (hydrostatic tension) inside the inclusions permits the existence of ice I crystals under reversible, metastable equilibrium, at temperatures as high as +6.5??C and negative pressures possibly exceeding 1000 bars.

  11. Conductance of P2X4 purinergic receptor is determined by conformational equilibrium in the transmembrane region.

    PubMed

    Minato, Yuichi; Suzuki, Shiho; Hara, Tomoaki; Kofuku, Yutaka; Kasuya, Go; Fujiwara, Yuichiro; Igarashi, Shunsuke; Suzuki, Ei-Ichiro; Nureki, Osamu; Hattori, Motoyuki; Ueda, Takumi; Shimada, Ichio

    2016-04-26

    Ligand-gated ion channels are partially activated by their ligands, resulting in currents lower than the currents evoked by the physiological full agonists. In the case of P2X purinergic receptors, a cation-selective pore in the transmembrane region expands upon ATP binding to the extracellular ATP-binding site, and the currents evoked by α,β-methylene ATP are lower than the currents evoked by ATP. However, the mechanism underlying the partial activation of the P2X receptors is unknown although the crystal structures of zebrafish P2X4 receptor in the apo and ATP-bound states are available. Here, we observed the NMR signals from M339 and M351, which were introduced in the transmembrane region, and the endogenous alanine and methionine residues of the zebrafish P2X4 purinergic receptor in the apo, ATP-bound, and α,β-methylene ATP-bound states. Our NMR analyses revealed that, in the α,β-methylene ATP-bound state, M339, M351, and the residues that connect the ATP-binding site and the transmembrane region, M325 and A330, exist in conformational equilibrium between closed and open conformations, with slower exchange rates than the chemical shift difference (<100 s(-1)), suggesting that the small population of the open conformation causes the partial activation in this state. Our NMR analyses also revealed that the transmembrane region adopts the open conformation in the state bound to the inhibitor trinitrophenyl-ATP, and thus the antagonism is due to the closure of ion pathways, except for the pore in the transmembrane region: i.e., the lateral cation access in the extracellular region.

  12. Conductance of P2X4 purinergic receptor is determined by conformational equilibrium in the transmembrane region

    PubMed Central

    Minato, Yuichi; Suzuki, Shiho; Hara, Tomoaki; Kofuku, Yutaka; Kasuya, Go; Fujiwara, Yuichiro; Igarashi, Shunsuke; Suzuki, Ei-ichiro; Nureki, Osamu; Hattori, Motoyuki; Ueda, Takumi; Shimada, Ichio

    2016-01-01

    Ligand-gated ion channels are partially activated by their ligands, resulting in currents lower than the currents evoked by the physiological full agonists. In the case of P2X purinergic receptors, a cation-selective pore in the transmembrane region expands upon ATP binding to the extracellular ATP-binding site, and the currents evoked by α,β-methylene ATP are lower than the currents evoked by ATP. However, the mechanism underlying the partial activation of the P2X receptors is unknown although the crystal structures of zebrafish P2X4 receptor in the apo and ATP-bound states are available. Here, we observed the NMR signals from M339 and M351, which were introduced in the transmembrane region, and the endogenous alanine and methionine residues of the zebrafish P2X4 purinergic receptor in the apo, ATP-bound, and α,β-methylene ATP-bound states. Our NMR analyses revealed that, in the α,β-methylene ATP-bound state, M339, M351, and the residues that connect the ATP-binding site and the transmembrane region, M325 and A330, exist in conformational equilibrium between closed and open conformations, with slower exchange rates than the chemical shift difference (<100 s−1), suggesting that the small population of the open conformation causes the partial activation in this state. Our NMR analyses also revealed that the transmembrane region adopts the open conformation in the state bound to the inhibitor trinitrophenyl-ATP, and thus the antagonism is due to the closure of ion pathways, except for the pore in the transmembrane region: i.e., the lateral cation access in the extracellular region. PMID:27071117

  13. WebAlchemist: a Web transcoding system for mobile Web access in handheld devices

    NASA Astrophysics Data System (ADS)

    Whang, Yonghyun; Jung, Changwoo; Kim, Jihong; Chung, Sungkwon

    2001-11-01

    In this paper, we describe the design and implementation of WebAlchemist, a prototype web transcoding system, which automatically converts a given HTML page into a sequence of equivalent HTML pages that can be properly displayed on a hand-held device. The Web/Alchemist system is based on a set of HTML transcoding heuristics managed by the Transcoding Manager (TM) module. In order to tackle difficult-to-transcode pages such as ones with large or complex table structures, we have developed several new transcoding heuristics that extract partial semantics from syntactic information such as the table width, font size and cascading style sheet. Subjective evaluation results using popular HTML pages (such as the CNN home page) show that WebAlchemist generates readable, structure-preserving transcoded pages, which can be properly displayed on hand-held devices.

  14. Iterative weighting of multiblock data in the orthogonal partial least squares framework.

    PubMed

    Boccard, Julien; Rutledge, Douglas N

    2014-02-27

    The integration of multiple data sources has emerged as a pivotal aspect to assess complex systems comprehensively. This new paradigm requires the ability to separate common and redundant from specific and complementary information during the joint analysis of several data blocks. However, inherent problems encountered when analysing single tables are amplified with the generation of multiblock datasets. Finding the relationships between data layers of increasing complexity constitutes therefore a challenging task. In the present work, an algorithm is proposed for the supervised analysis of multiblock data structures. It associates the advantages of interpretability from the orthogonal partial least squares (OPLS) framework and the ability of common component and specific weights analysis (CCSWA) to weight each data table individually in order to grasp its specificities and handle efficiently the different sources of Y-orthogonal variation. Three applications are proposed for illustration purposes. A first example refers to a quantitative structure-activity relationship study aiming to predict the binding affinity of flavonoids toward the P-glycoprotein based on physicochemical properties. A second application concerns the integration of several groups of sensory attributes for overall quality assessment of a series of red wines. A third case study highlights the ability of the method to combine very large heterogeneous data blocks from Omics experiments in systems biology. Results were compared to the reference multiblock partial least squares (MBPLS) method to assess the performance of the proposed algorithm in terms of predictive ability and model interpretability. In all cases, ComDim-OPLS was demonstrated as a relevant data mining strategy for the simultaneous analysis of multiblock structures by accounting for specific variation sources in each dataset and providing a balance between predictive and descriptive purpose. Copyright © 2014 Elsevier B.V. All rights reserved.

  15. Wetting of a partially immersed compliant rod

    NASA Astrophysics Data System (ADS)

    Hui, Chung-Yuen; Jagota, Anand

    2016-11-01

    The force on a solid rod partially immersed in a liquid is commonly used to determine the liquid-vapor surface tension by equating the measured force required to remove the rod from the liquid to the vertical component of the liquid-vapor surface tension. Here, we study how this process is affected when the rod is compliant. For equilibrium, we enforce force and configurational energy balance, including contributions from elastic energy. We show that, in general, the contact angle does not equal that given by Young's equation. If surface stresses are tensile, the strain in the immersed part of the rod is found to be compressive and to depend only on the solid-liquid surface stress. The strain in the dry part of the rod can be either tensile or compressive, depending on a combination of parameters that we identify. We also provide results for compliant plates partially immersed in a liquid under plane strain and plane stress. Our results can be used to extract solid surface stresses from such experiments.

  16. DOE Office of Scientific and Technical Information (OSTI.GOV)

    Karabourniotis, D.; Couris, S.; Damelincourt, J.J.

    The partial pressure of thallium in high-pressure Hg-TlI discharges with different mercury, thallium, and electron pressures has been measured by using the optically thin line Tl 655 nm and the self-reversed line Tl 535 nm. The partial pressure of the arc axis has been measured from the line Tl 655nm. The effective partial pressure has been measured from the self-reversed line Tl 535 nm on the basis of the multiparameter method, and it has been calculated from the known axis pressure of thallium and the calculation of its radial variation by taking into account the chemical reactions. The experimental resultsmore » confirm the dispersion character of the blue wing of the line Tl 535 nm. The systematic difference obtained between the measured and calculated effective pressure, particularly at the moment of minimum electron density, may be interpreted by deviations from the local thermodynamic equilibrium (LTE) caused by overpopulation of the upper level of the line Tl 535 nm.« less

  17. Infinitely dilute partial molar properties of proteins from computer simulation.

    PubMed

    Ploetz, Elizabeth A; Smith, Paul E

    2014-11-13

    A detailed understanding of temperature and pressure effects on an infinitely dilute protein's conformational equilibrium requires knowledge of the corresponding infinitely dilute partial molar properties. Established molecular dynamics methodologies generally have not provided a way to calculate these properties without either a loss of thermodynamic rigor, the introduction of nonunique parameters, or a loss of information about which solute conformations specifically contributed to the output values. Here we implement a simple method that is thermodynamically rigorous and possesses none of the above disadvantages, and we report on the method's feasibility and computational demands. We calculate infinitely dilute partial molar properties for two proteins and attempt to distinguish the thermodynamic differences between a native and a denatured conformation of a designed miniprotein. We conclude that simple ensemble average properties can be calculated with very reasonable amounts of computational power. In contrast, properties corresponding to fluctuating quantities are computationally demanding to calculate precisely, although they can be obtained more easily by following the temperature and/or pressure dependence of the corresponding ensemble averages.

  18. Dissolution Rate of Propellant Energetics from Nitrocellulose Matrices

    DTIC Science & Technology

    2012-09-01

    propellants are generally composed of a polymer, a plasticizer , and a stabilizer. These three compo- nents provide the structure, contribute the oxygen...million lb) of nitrocel- lulose is manufactured each year in the U.S. (Richie 2012; a partial listing is given in Table A1). This wood -like compound...that single- and double-base propellants are transparent to translucent and show signs of having been extruded (Fig. 10). Figure 10. Thin section

  19. Design and Analysis of Chronic Aquatic Tests of Toxicity with Daphnia magna.

    DTIC Science & Technology

    1981-12-01

    surface waters. From that need evolved numerous standard toxicity tests. Aquatic toxicologists and biologists developed, refine,, and standard- ized many...experimental categorization summary sheets prepared by Dr. William van der Schalie, which is shown in Table I.I. 7 j-. " .’?, i...partial solution to this dilema can be obtained by studying the effects of the solvent alone. If the solvent by itself produces no toxic responses at

  20. The Mechanism of Blood Function and Production After Injury.

    DTIC Science & Technology

    1980-02-01

    radioactive 59Fe labeled red cell dilution method described by Garcia7 . Red cell 2,3 diphosphoglycerate levels were measured using a commercial kit...and protein depleted rats was also associated with elevated 2,3 diphosphoglycerate levels (p<.05)(Table IV) suggesting partial compensation for anemic...Brewer, G.J.: The relationship between red cell 2,3 diphosphoglycerate and levels of hemoglobin in the human. Proc.Soc. Exp.Biol.Med. 150(1): 215-9

  1. Total solar eclipse of 3 November 1994

    NASA Technical Reports Server (NTRS)

    Espenak, Fred; Anderson, Jay

    1993-01-01

    A total eclipse of the Sun will be visible from the southern half of the Western Hemisphere on 3 November 1994. The path of the Moon's shadow passes through Peru, Chile, Bolivia, Paraguay, and Brazil. Detailed predictions for this event are presented and include tables of geographic coordinates of the path of totality, local circumstances for hundreds of cities, maps of the path of total and partial eclipse, weather prospects, and the lunar limb profile.

  2. Multi-component testing using HZ-PAN and AgZ-PAN Sorbents for OSPREY Model validation

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Garn, Troy G.; Greenhalgh, Mitchell; Lyon, Kevin L.

    2015-04-01

    In efforts to further develop the capability of the Off-gas SeParation and RecoverY (OSPREY) model, multi-component tests were completed using both HZ-PAN and AgZ-PAN sorbents. The primary purpose of this effort was to obtain multi-component xenon and krypton capacities for comparison to future OSPREY predicted multi-component capacities using previously acquired Langmuir equilibrium parameters determined from single component isotherms. Experimental capacities were determined for each sorbent using two feed gas compositions of 1000 ppmv xenon and 150 ppmv krypton in either a helium or air balance. Test temperatures were consistently held at 220 K and the gas flowrate was 50 sccm.more » Capacities were calculated from breakthrough curves using TableCurve® 2D software by Jandel Scientific. The HZ-PAN sorbent was tested in the custom designed cryostat while the AgZ-PAN was tested in a newly installed cooling apparatus. Previous modeling validation efforts indicated the OSPREY model can be used to effectively predict single component xenon and krypton capacities for both engineered form sorbents. Results indicated good agreement with the experimental and predicted capacity values for both krypton and xenon on the sorbents. Overall, the model predicted slightly elevated capacities for both gases which can be partially attributed to the estimation of the parameters and the uncertainty associated with the experimental measurements. Currently, OSPREY is configured such that one species adsorbs and one does not (i.e. krypton in helium). Modification of OSPREY code is currently being performed to incorporate multiple adsorbing species and non-ideal interactions of gas phase species with the sorbent and adsorbed phases. Once these modifications are complete, the sorbent capacities determined in the present work will be used to validate OSPREY multicomponent adsorption predictions.« less

  3. Multidimensional flamelet-generated manifolds for partially premixed combustion

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Nguyen, Phuc-Danh; Vervisch, Luc; Subramanian, Vallinayagam

    2010-01-15

    Flamelet-generated manifolds have been restricted so far to premixed or diffusion flame archetypes, even though the resulting tables have been applied to nonpremixed and partially premixed flame simulations. By using a projection of the full set of mass conservation species balance equations into a restricted subset of the composition space, unsteady multidimensional flamelet governing equations are derived from first principles, under given hypotheses. During the projection, as in usual one-dimensional flamelets, the tangential strain rate of scalar isosurfaces is expressed in the form of the scalar dissipation rates of the control parameters of the multidimensional flamelet-generated manifold (MFM), which ismore » tested in its five-dimensional form for partially premixed combustion, with two composition space directions and three scalar dissipation rates. It is shown that strain-rate-induced effects can hardly be fully neglected in chemistry tabulation of partially premixed combustion, because of fluxes across iso-equivalence-ratio and iso-progress-of-reaction surfaces. This is illustrated by comparing the 5D flamelet-generated manifold with one-dimensional premixed flame and unsteady strained diffusion flame composition space trajectories. The formal links between the asymptotic behavior of MFM and stratified flame, weakly varying partially premixed front, triple-flame, premixed and nonpremixed edge flames are also evidenced. (author)« less

  4. Capacity retention in hydrogen storage alloys

    NASA Technical Reports Server (NTRS)

    Anani, A.; Visintin, A.; Srinivasan, S.; Appleby, A. J.; Reilly, J. J.; Johnson, J. R.

    1992-01-01

    Results of our examination of the properties of several candidate materials for hydrogen storage electrodes and their relation to the decrease in H-storage capacity upon open-circuit storage over time are reported. In some of the alloy samples examined to date, only about 10 percent of the hydrogen capacity was lost upon storage for 20 days, while in others, this number was as high as 30 percent for the same period of time. This loss in capacity is attributed to two separate mechanisms: (1) hydrogen desorbed from the electrode due to pressure differences between the cell and the electrode sample; and (2) chemical and/or electrochemical degradation of the alloy electrode upon exposure to the cell environment. The former process is a direct consequence of the equilibrium dissociation pressure of the hydride alloy phase and the partial pressure of hydrogen in the hydride phase in equilibrium with that in the electrolyte environment, while the latter is related to the stability of the alloy phase in the cell environment. Comparison of the equilibrium gas-phase dissociation pressures of these alloys indicate that reversible loss of hydrogen capacity is higher in alloys with P(eqm) greater than 1 atm than in those with P(eqm) less than 1 atm.

  5. Direct numerical simulation of turbulent H2-O2 combustion using reduced chemistry

    NASA Technical Reports Server (NTRS)

    Montgomery, Christopher J.; Kosaly, George; Riley, James J.

    1993-01-01

    Results of direct numerical simulations of hydrogen-oxygen combustion using a partial-equilibrium chemistry scheme in constant density, decaying, isotropic turbulence are reported. The simulations qualitatively reproduce many features of experimental results, such as superequilibrium radical species mole fractions, with temperature and major species mole fractions closer to chemical equilibrium. It was also observed that the peak reaction rates occur in narrow zones where the stoichiometric surface intersects regions of high scalar dissipation, as might be expected for combustion conditions close to chemical equilibrium. Another finding was that high OH mole fraction correspond more closely to the stoichiometric surface than to areas of high reaction rate for conditions of the simulations. Simulation results were compared to predictions of the Conditional Moment Closure model. This model was found to give good results for all quantities of interest when the conditionally averaged scalar dissipation was used in the prediction. When the nonconditioned average dissipation was used, the predictions compared well to the simulations for most of the species and temperature, but not for the reaction rate. The comparison would be expected to improve for higher Reynolds number flows, however.

  6. Privacy-preserving genome-wide association studies on cloud environment using fully homomorphic encryption.

    PubMed

    Lu, Wen-Jie; Yamada, Yoshiji; Sakuma, Jun

    2015-01-01

    Developed sequencing techniques are yielding large-scale genomic data at low cost. A genome-wide association study (GWAS) targeting genetic variations that are significantly associated with a particular disease offers great potential for medical improvement. However, subjects who volunteer their genomic data expose themselves to the risk of privacy invasion; these privacy concerns prevent efficient genomic data sharing. Our goal is to presents a cryptographic solution to this problem. To maintain the privacy of subjects, we propose encryption of all genotype and phenotype data. To allow the cloud to perform meaningful computation in relation to the encrypted data, we use a fully homomorphic encryption scheme. Noting that we can evaluate typical statistics for GWAS from a frequency table, our solution evaluates frequency tables with encrypted genomic and clinical data as input. We propose to use a packing technique for efficient evaluation of these frequency tables. Our solution supports evaluation of the D' measure of linkage disequilibrium, the Hardy-Weinberg Equilibrium, the χ2 test, etc. In this paper, we take χ2 test and linkage disequilibrium as examples and demonstrate how we can conduct these algorithms securely and efficiently in an outsourcing setting. We demonstrate with experimentation that secure outsourcing computation of one χ2 test with 10, 000 subjects requires about 35 ms and evaluation of one linkage disequilibrium with 10, 000 subjects requires about 80 ms. With appropriate encoding and packing technique, cryptographic solutions based on fully homomorphic encryption for secure computations of GWAS can be practical.

  7. Design Model for the Heat Transfer in a Short Straight Tube Boiler.

    DTIC Science & Technology

    1981-06-01

    Equilibrium Quality XT - True Quality XTT - Martinelli Parameter Dimensionless Groups Nu - Nusselt Number Pr - Prandtl Number Re - Reynolds Number...fill a cylinder in which a piston was mounted. When the steam was suddenly condensed by a spray of water, a partial vacuum was created, and the piston...BOILER - 1725 SFET YAL OOS _ FIGURE 6: JAMES WATTS WAGON-TYPE BOILER - 1785 25 water-inlet, a condensate return, a steam outlet, a gauge glass for

  8. Removal of Oxygen from Electronic Materials by Vapor-Phase Processes

    NASA Technical Reports Server (NTRS)

    Palosz, Witold

    1997-01-01

    Thermochemical analyses of equilibrium partial pressures over oxides with and without the presence of the respective element condensed phase, and hydrogen, chalcogens, hydrogen chalcogenides, and graphite are presented. Theoretical calculations are supplemented with experimental results on the rate of decomposition and/or sublimation/vaporization of the oxides under dynamic vacuum, and on the rate of reaction with hydrogen, graphite, and chalcogens. Procedures of removal of a number of oxides under different conditions are discussed.

  9. DOE Office of Scientific and Technical Information (OSTI.GOV)

    Hu, Shenyang; Setyawan, Wahyu; Joshi, Vineet V.

    Xe gas bubble superlattice formation is observed in irradiated uranium–10 wt% molybdenum (U10Mo) fuels. However, the thermodynamic properties of the bubbles (the relationship among bubble size, equilibrium Xe concentration, and bubble pressure) and the mechanisms of bubble growth and superlattice formation are not well known. In this work, molecular dynamics is used to study these properties and mechanisms. The results provide important inputs for quantitative mesoscale models of gas bubble evolution and fuel performance. In the molecular dynamics simulations, the embedded-atom method (EAM) potential of U10Mo-Xe (Smirnova et al. 2013) is employed. Initial gas bubbles with low Xe concentration aremore » generated in a U10Mo single crystal. Then Xe atom atoms are continuously added into the bubbles, and the evolution of pressure and dislocation emission around the bubbles is analyzed. The relationship between pressure, equilibrium Xe concentration, and radius of the bubbles is established. It was found that the gas bubble growth is accompanied by partial dislocation emission, which results in a star-shaped dislocation structure and an anisotropic stress field. The emitted partial dislocations have a Burgers vector along the <111> direction and a slip plane of (11-2). Dislocation loop punch-out was not observed. A tensile stress was found along <110> directions around the bubble, favoring the nucleation and formation of a face-centered cubic bubble superlattice in body-centered cubic U10Mo fuels.« less

  10. "Multiple partial recognitions in dynamic equilibrium" in the binding sites of proteins form the molecular basis of promiscuous recognition of structurally diverse ligands.

    PubMed

    Kohda, Daisuke

    2018-04-01

    Promiscuous recognition of ligands by proteins is as important as strict recognition in numerous biological processes. In living cells, many short, linear amino acid motifs function as targeting signals in proteins to specify the final destination of the protein transport. In general, the target signal is defined by a consensus sequence containing wild-characters, and hence represented by diverse amino acid sequences. The classical lock-and-key or induced-fit/conformational selection mechanism may not cover all aspects of the promiscuous recognition. On the basis of our crystallographic and NMR studies on the mitochondrial Tom20 protein-presequence interaction, we proposed a new hypothetical mechanism based on "a rapid equilibrium of multiple states with partial recognitions". This dynamic, multiple recognition mode enables the Tom20 receptor to recognize diverse mitochondrial presequences with nearly equal affinities. The plant Tom20 is evolutionally unrelated to the animal Tom20 in our study, but is a functional homolog of the animal/fungal Tom20. NMR studies by another research group revealed that the presequence binding by the plant Tom20 was not fully explained by simple interaction modes, suggesting the presence of a similar dynamic, multiple recognition mode. Circumstantial evidence also suggested that similar dynamic mechanisms may be applicable to other promiscuous recognitions of signal peptides by the SRP54/Ffh and SecA proteins.

  11. Gas-liquid equilibrium in a CO{sub 2}-MDEA-H{sub 2}O system and the effect of piperazine on it

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Xu, G.W.; Zhang, C.F.; Qin, S.J.

    1998-04-01

    Aqueous N-methyldiethanolamine (MDEA) solutions are widely used for removal of the acid gas (H{sub 2}S and CO{sub 2}) from natural gas synthesis and refinery gas streams. Solubility data of CO{sub 2} and vapor pressure of water in 3.04--4.28 kmol/m{sup 3} aqueous N-methyldiethanolamine (MDEA) solutions were obtained at temperatures ranging from 40 to 100 C and CO{sub 2} partial pressures ranging from 0.876 to 1,013 kPa. A thermodynamic model was proposed and used for predicting CO{sub 2} solubility and water vapor pressure. An enthalpy change of absorption of CO{sub 2} in 4.28 kmol/m{sup 3} MDEA solution was estimated. The effect ofmore » piperazine (PZ) concentration on CO{sub 2} loading in MDEA solutions was determined at piperazine concentration ranging from 0 to 0.515 kmol/m{sup 3}. The results show that piperazine is beneficial to the CO{sub 2} loading. The equilibrium partial pressure of piperazine in the PZ-MDEA-H{sub 2}O system was measured in an Ellis Cell. Results show that the PZ-MDEA-H{sub 2}O system is a typical negative deviation system, with the strength of deviation decreasing with MDEA solutions.« less

  12. An index of effluent aquatic toxicity designed by partial least squares regression, using acute and chronic tests and expert judgements.

    PubMed

    Vindimian, Éric; Garric, Jeanne; Flammarion, Patrick; Thybaud, Éric; Babut, Marc

    1999-10-01

    The evaluation of the ecotoxicity of effluents requires a battery of biological tests on several species. In order to derive a summary parameter from such a battery, a single endpoint was calculated for all the tests: the EC10, obtained by nonlinear regression, with bootstrap evaluation of the confidence intervals. Principal component analysis was used to characterize and visualize the correlation between the tests. The table of the toxicity of the effluents was then submitted to a panel of experts, who classified the effluents according to the test results. Partial least squares (PLS) regression was used to fit the average value of the experts' judgements to the toxicity data, using a simple equation. Furthermore, PLS regression on partial data sets and other considerations resulted in an optimum battery, with two chronic tests and one acute test. The index is intended to be used for the classification of effluents based on their toxicity to aquatic species. Copyright © 1999 SETAC.

  13. An index of effluent aquatic toxicity designed by partial least squares regression, using acute and chronic tests and expert judgments

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Vindimian, E.; Garric, J.; Flammarion, P.

    1999-10-01

    The evaluation of the ecotoxicity of effluents requires a battery of biological tests on several species. In order to derive a summary parameter from such a battery, a single endpoint was calculated for all the tests: the EC10, obtained by nonlinear regression, with bootstrap evaluation of the confidence intervals. Principal component analysis was used to characterize and visualize the correlation between the tests. The table of the toxicity of the effluents was then submitted to a panel of experts, who classified the effluents according to the test results. Partial least squares (PLS) regression was used to fit the average valuemore » of the experts' judgments to the toxicity data, using a simple equation. Furthermore, PLS regression on partial data sets and other considerations resulted in an optimum battery, with two chronic tests and one acute test. The index is intended to be used for the classification of effluents based on their toxicity to aquatic species.« less

  14. Isochoric Burn, an Internally Consistent Method for the Reactant to Product Transformation in Reactive Flow

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Reaugh, J E; Lee, E L

    2002-07-01

    Mixture rules for partially reacted explosives differ amongst various models. For instance, JWL++ uses a partial pressure addition to compute an average zonal pressure, Ignition and Growth requires pressure equilibration and thermal equilibration of temperature dependent JWL EOSs, CHEETAH In Line RF also assumes temperature and pressure equilibration. It has been suggested in the past that a more realistic equilibration scheme should comprise isentropic pressure equilibration of the separate reacted and unreacted phases. This turns out not to be a proper path for equilibration. Rather, we find that the only internally consistent method is the evaluation of the equilibrium pressuremore » that satisfies the particular conditions of reactant and product resulting from deflagration in a fixed volume.« less

  15. Transport coefficients of dense fluids composed of globular molecules. Equilibrium molecular dynamics investigations using more-center Lennard-Jones potentials

    NASA Astrophysics Data System (ADS)

    Hoheisel, C.

    1988-09-01

    Equilibrium molecular dynamics calculations with constraints have been performed for model liquids SF6 and CF4. The computations were carried out with four- and six-center Lennard-Jones potentials and up to 2×105 integration steps. Shear, bulk viscosity and the thermal conductivity have been calculated with use of Green-Kubo relations in the formulation of ``molecule variables.'' Various thermodynamic states were investigated. For SF6, a detailed comparison with experimental data was possible. For CF4, the MD results could only be compared with experiment for one liquid state. For the latter liquid, a complementary comparison was performed using MD results obtained with a one-center Lennard-Jones potential. A limited test of the particle number dependence of the results is presented. Partial and total correlations functions are shown and discussed with respect to findings obtained for the one-center Lennard-Jones liquid.

  16. DOE Office of Scientific and Technical Information (OSTI.GOV)

    Fincke, J.R.; Swank, W.D.; Haggard, D.C.

    This paper describes the experimental demonstration of a process for the direct plasma reduction of depleted uranium hexafluoride to uranium metal. The process exploits the large departures from equilibrium that can be achieved in the rapid supersonic expansion of a totally dissociated and partially ionized mixture of UF{sub 6}, Ar, He, and H{sub 2}. The process is based on the rapid condensation of subcooled uranium vapor and the relatively slow rate of back reaction between metallic uranium and HF to F{sub 2} to reform stable fluorides. The high translational velocities and rapid cooling result in an overpopulation of atomic hydrogenmore » which persists throughout the expansion process. Atomic hydrogen shifts the equilibrium composition by inhibiting the reformation of uranium-fluorine compounds. This process has the potential to reduce the cost of reducing UF{sub 6} to uranium metal with the added benefit of being a virtually waste free process. The dry HF produced is a commodity which has industrial value.« less

  17. Experimental partitioning of rare earth elements and scandium among armalcolite, ilmenite, olivine and mare basalt liquid

    NASA Technical Reports Server (NTRS)

    Irving, A. J.; Merrill, R. B.; Singleton, D. E.

    1978-01-01

    An experimental study was carried out to measure partition coefficients for two rare-earth elements (Sm and Tm) and Sc among armalcolite, ilmenite, olivine and liquid coexisting in a system modeled on high-Ti mare basalt 74275. This 'primitive' sample was chosen for study because its major and trace element chemistry as well as its equilibrium phase relations at atmospheric pressure are known from previous studies. Beta-track analytical techniques were used so that partition coefficients could be measured in an environment whose bulk trace element composition is similar to that of the natural basalt. Partition coefficients for Cr and Mn were determined in the same experiments by microprobe analysis. The only equilibrium partial melting model appears to be one in which ilmenite is initially present in the source region but is consumed by melting before segregation of the high-Ti mare basalt liquid from the residue.

  18. Thermodynamic characterization of hydrogen interaction with iridium polyhydride complexes

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Zidan, R.A.; Rocheleau, R.E.

    1999-01-01

    Hydrogen interaction with solid iridium complexes IrXH{sub 2}(PPr3{sup i}){sub 2} (X=Cl, I) was investigated. Gaseous hydrogen was found to react reversibly with solid chloro-iridium complex IrClH{sub 2}(PPr3{sup i}){sub 2} forming IrClH{sub 2}(PPr3{sup i}){sub 2}H{sub 2}. The relative partial molal enthalpy and entropy were obtained from equilibrium isotherms at different hydrogen concentrations. The decrease in entropy with increasing hydrogen concentration and the absence of plateaus in the equilibrium isotherms were consistent with a single phase solid solution with two chemical components. Hydrogen release from solid iodo-iridium complex IrIH{sub 2}(PPr3{sup i}){sub 2}H{sub 2} was not observed at temperatures up to 350 K,more » indicating stronger hydrogen bonding. {copyright} {ital 1999 Materials Research Society.}« less

  19. Fracture of an isotropic medium strengthened with a regular system of stringers

    NASA Astrophysics Data System (ADS)

    Mir-Salim-zadeh, M. V.

    2007-01-01

    An isotropic medium containing a system of foreign transverse rectilinear inclusions is considered. Such a medium can be interpreted as an infinite plate strengthened with a regular system of ribs (stringers) whose cross section is a very narrow rectangle. The medium is weakened by a periodic system of rectilinear cracks. The action of the stringers is re placed by unknown equivalent concentrated forces at the points of their connection with the medium. The boundary-value problem on equilibrium of the periodic system of cracks under the action of external tensile forces is reduced to a singular integral equation, from the solution of which the stress in tensity factors are found. The condition of limiting state of equilibrium of the cracks is formulated based on a criterion of brittle fracture. The stress state in the case where crack faces come into a partial contact is also considered.

  20. Lumpy investment, sectoral propagation, and business cycles (Invited Paper)

    NASA Astrophysics Data System (ADS)

    Nirei, Makoto

    2005-05-01

    This paper proposes a model of endogenous fluctuations in investment. A monopolistic producer has an incentive to invest when the aggregate demand is high. The investment at the firm level is also known to exhibit a threshold behavior called an (S,s) policy. These two facts lead us to consider that the fluctuation in aggregate investment is generated by the global coupling of the non-linear oscillators. From this perspective, we characterize the probability distribution of the investment clustering in a partial equilibrium of product markets, and show that its variance can be large enough to match the observed investment fluctuations. We then implement this mechanism in a dynamic general equilibrium model to explore an investment-driven business cycle. By calibrating the model with the SIC 4-digit level industry data, we numerically show that the model replicates the basic structure of the business cycles.

  1. The surface stability and morphology of tobermorite 11 Å from first principles

    NASA Astrophysics Data System (ADS)

    Mutisya, Sylvia M.; Miranda, Caetano R.

    2018-06-01

    Tobermorite minerals are important in many industrial processes typically occurring in hydrous environment. Their functionality is therefore governed in various aspects by their morphology and surface stability/reactivity. Here, we present the results of the surface energies and morphology of normal tobermorite 11 Å in a water vapor environment investigated by employing first principles atomistic thermodynamic calculations. For the low index tobermorite surfaces studied, the calculated surface energies fall within a narrow range (0.41-0.97 J/m2) with the (0 0 4) surface being the most stable. The equilibrium morphology is a thin pseudohexagonal plate elongated along the b axis. The hydrated surfaces are more stable at high water vapor chemical potentials with the stability enhanced as the water partial pressures are varied from ambient to supercritical hydrothermal conditions. Increasing the water vapor chemical potential gives rise to a smaller size of the tobermorite crystal, with the equilibrium morphology remaining unaltered.

  2. Solubility of noble gases in serpentine - Implications for meteoritic noble gas abundances

    NASA Technical Reports Server (NTRS)

    Zaikowski, A.; Schaeffer, O. A.

    1979-01-01

    An investigation of the solubilities of the noble gases from synthesis and solubility studies of the sheet silicate mineral serpentine in carbonaceous chondrites is presented. Hydrothermal synthesis and exchange experiments were made at 340C and 1 kbar with noble gas partial pressures from 2 times 10 to the -8th power to 0.1 atm. The measured distribution coefficients for noble gases are not sufficiently high to account for the trapped noble gases in carbonaceous chondrites by exchange in solar nebula if meteoritic minerals have comparable distribution coefficients. Also, serpentine gains and loses noble gases to approach equilibrium values with the terrestrial atmosphere, indicating that this exposure may have influenced the noble gas abundances in phyllosilicate minerals of these chondrites. The dispersion of K-Ar ages of carbonaceous chondrites could be the result of phyllosilicates approaching equilibrium solubility of atmospheric Ar-40.

  3. Effect of pressure on the Raman-active modes of zircon (ZrSiO4): a first-principles study

    NASA Astrophysics Data System (ADS)

    Sheremetyeva, Natalya; Cherniak, Daniele J.; Watson, E. Bruce; Meunier, Vincent

    2018-02-01

    Density-functional theory (DFT) was employed in a first-principles study of the effects of pressure on the Raman-active modes of zircon (ZrSiO4), using both the generalized gradient and local density approximations (GGA and LDA, respectively). Beginning with the equilibrium structure at zero pressure, we conducted a calibration of the effect of pressure in a manner procedurally similar to an experimental calibration. For pressures between 0 and 7 GPa, we find excellent qualitative agreement of frequency-pressure slopes partial ω /partial P calculated from GGA DFT with results of previous experimental studies. In addition, we were able to rationalize the ω vs. P behavior based on details of the vibrational modes and their atomic displacements. Most of the partial ω /partial P slopes are positive as expected, but the symmetry of the zircon lattice also results in two negative slopes for modes that involve slight shearing and rigid rotation of SiO4 tetrahedra. Overall, LDA yields absolute values of the frequencies of the Raman-active modes in good agreement with experimental values, while GGA reproduces the shift in frequency with pressure especially well.

  4. Analysis of a two-dimensional type 6 shock-interference pattern using a perfect-gas code and a real-gas code

    NASA Technical Reports Server (NTRS)

    Bertin, J. J.; Graumann, B. W.

    1973-01-01

    Numerical codes were developed to calculate the two dimensional flow field which results when supersonic flow encounters double wedge configurations whose angles are such that a type 4 pattern occurs. The flow field model included the shock interaction phenomena for a delta wing orbiter. Two numerical codes were developed, one which used the perfect gas relations and a second which incorporated a Mollier table to define equilibrium air properties. The two codes were used to generate theoretical surface pressure and heat transfer distributions for velocities from 3,821 feet per second to an entry condition of 25,000 feet per second.

  5. Na(+) transport, and the E(1)P-E(2)P conformational transition of the Na(+)/K(+)-ATPase.

    PubMed Central

    Babes, A; Fendler, K

    2000-01-01

    We have used admittance analysis together with the black lipid membrane technique to analyze electrogenic reactions within the Na(+) branch of the reaction cycle of the Na(+)/K(+)-ATPase. ATP release by flash photolysis of caged ATP induced changes in the admittance of the compound membrane system that are associated with partial reactions of the Na(+)/K(+)-ATPase. Frequency spectra and the Na(+) dependence of the capacitive signal are consistent with an electrogenic or electroneutral E(1)P <--> E(2)P conformational transition which is rate limiting for a faster electrogenic Na(+) dissociation reaction. We determine the relaxation rate of the rate-limiting reaction and the equilibrium constants for both reactions at pH 6.2-8.5. The relaxation rate has a maximum value at pH 7.4 (approximately 320 s(-1)), which drops to acidic (approximately 190 s(-1)) and basic (approximately 110 s(-1)) pH. The E(1)P <--> E(2)P equilibrium is approximately at a midpoint position at pH 6.2 (equilibrium constant approximately 0.8) but moves more to the E(1)P side at basic pH 8.5 (equilibrium constant approximately 0.4). The Na(+) affinity at the extracellular binding site decreases from approximately 900 mM at pH 6.2 to approximately 200 mM at pH 8.5. The results suggest that during Na(+) transport the free energy supplied by the hydrolysis of ATP is mainly used for the generation of a low-affinity extracellular Na(+) discharge site. Ionic strength and lyotropic anions both decrease the relaxation rate. However, while ionic strength does not change the position of the conformational equilibrium E(1)P <--> E(2)P, lyotropic anions shift it to E(1)P. PMID:11053130

  6. On axisymmetric resistive MHD equilibria with flow free of Pfirsch-Schlüter diffusion

    NASA Astrophysics Data System (ADS)

    Throumoulopoulos, George N.; Tasso, Henri

    2002-11-01

    The equilibrium of an axisymmetric magnetically confined plasma with anisotropic electrical conductivity and flows parallel to the magnetic field is investigated within the framework of the MHD theory by keeping the convective flow term in the momentum equation. It turns out that the stationary states are determined by a second-order partial differential equation for the poloidal magnetic flux function along with a Bernoulli equation for the density identical in form with the respective ideal MHD equations; equilibrium consistent expressions for the conductivities σ_allel and σ_⊥ parallel and perpendicular to the magnetic field are also derived from Ohm's and Faraday's laws. Unlike in the case of stationary states with isotropic conductivity and parallel flows (see [1]) the equilibrium is compatible with non-vanishing poloidal currents. For incompressible flows exact solutions of the above mentioned set of equations can be constructed with σ_allel and σ_⊥ profiles compatible with collisional conductivity profiles, i.e. profiles peaked close to the magnetic axis, vanishing on the boundary and such that σ_allel> σ_⊥. In particular, an exact equilibrium describing a toroidal plasma of arbitrary aspect ratio being contained within a perfectly conducting boundary of rectangular cross-section and peaked toroidal current density profile vanishing on the boundary is further considered. For this equilibrium in the case of vanishing flows the difference σ_allel-σ_⊥ for the reversed field pinch scaling Bp Bt (where Bp and Bt are the poloidal and toroidal magnetic field components) is nearly two times larger than that for the tokamak scaling B_p 0.1 B_t. [1] G. N. Throumoulopoulos, H. Tasso, J. Plasma Physics 64, 601 (2000).

  7. ASHEE: a compressible, Equilibrium-Eulerian model for volcanic ash plumes

    NASA Astrophysics Data System (ADS)

    Cerminara, M.; Esposti Ongaro, T.; Berselli, L. C.

    2015-10-01

    A new fluid-dynamic model is developed to numerically simulate the non-equilibrium dynamics of polydisperse gas-particle mixtures forming volcanic plumes. Starting from the three-dimensional N-phase Eulerian transport equations (Neri et al., 2003) for a mixture of gases and solid dispersed particles, we adopt an asymptotic expansion strategy to derive a compressible version of the first-order non-equilibrium model (Ferry and Balachandar, 2001), valid for low concentration regimes (particle volume fraction less than 10-3) and particles Stokes number (St, i.e., the ratio between their relaxation time and flow characteristic time) not exceeding about 0.2. The new model, which is called ASHEE (ASH Equilibrium Eulerian), is significantly faster than the N-phase Eulerian model while retaining the capability to describe gas-particle non-equilibrium effects. Direct numerical simulation accurately reproduce the dynamics of isotropic, compressible turbulence in subsonic regime. For gas-particle mixtures, it describes the main features of density fluctuations and the preferential concentration and clustering of particles by turbulence, thus verifying the model reliability and suitability for the numerical simulation of high-Reynolds number and high-temperature regimes in presence of a dispersed phase. On the other hand, Large-Eddy Numerical Simulations of forced plumes are able to reproduce their observed averaged and instantaneous flow properties. In particular, the self-similar Gaussian radial profile and the development of large-scale coherent structures are reproduced, including the rate of turbulent mixing and entrainment of atmospheric air. Application to the Large-Eddy Simulation of the injection of the eruptive mixture in a stratified atmosphere describes some of important features of turbulent volcanic plumes, including air entrainment, buoyancy reversal, and maximum plume height. For very fine particles (St → 0, when non-equilibrium effects are negligible) the model reduces to the so-called dusty-gas model. However, coarse particles partially decouple from the gas phase within eddies (thus modifying the turbulent structure) and preferentially concentrate at the eddy periphery, eventually being lost from the plume margins due to the concurrent effect of gravity. By these mechanisms, gas-particle non-equilibrium processes are able to influence the large-scale behavior of volcanic plumes.

  8. Microstructures and formation history of melilite-rich calcium-aluminum-rich inclusions from the ALHA77307 CO3.0 chondrite

    NASA Astrophysics Data System (ADS)

    Han, Jangmi; Brearley, Adrian J.

    2017-03-01

    We have studied four melilite-rich calcium-aluminum-rich inclusions (CAIs) from the Allan Hills A77307 CO3.0 chondrite using transmission electron microscopy with the focused ion beam sample preparation technique. This type of CAI represents one of the dominant types of refractory inclusions in CO3 chondrites. Individual melilite-rich CAIs 04-07 record complex formational histories involving high-temperature gas-solid condensation that occurred under both equilibrium and disequilibrium conditions. CAI 04 contains two texturally- and compositionally-distinct occurrences of perovskite: fine-grained perovskite within a melilite-rich core and aggregates of perovskite grains that surround the core. The perovskite in the core was probably involved in a disequilibrium reaction with early equilibrium condensates (e.g., melilite and spinel) and a nebular gas to form Al-Ti-rich diopside, followed by a later condensation of the perovskite aggregates under equilibrium conditions. CAI 05 has a compact melilite-rich core surrounded by a porous mantle, and likely formed by at least two different condensation events under equilibrium and disequilibrium conditions. In CAI 06, complex intergrowth layers of spinel and diopside surrounding a melilite-rich core indicate disequilibrium reaction of spinel and melilite with a nebular gas to form Al-Ti-rich diopside following core formation by equilibrium condensation. CAI 07 is dominated by melilite with a narrow compositional range and equilibrated textures, suggesting its formation by equilibrium condensation over a limited temperature range. Collectively, we infer that the melilite-rich inclusions formed by a generalized sequence of high-temperature gas-solid condensation that involved: (1) formation of CAI cores by aggregation of primary equilibrium condensates (i.e., perovskite, spinel, and melilite), (2) back-reactions of the primary core minerals with a nebular gas under disequilibrium conditions, forming diopside that evolves in composition from Al-Ti-rich at the interface with the inclusion core to Al-Ti-poor on the exterior of the inclusions. The change in formation conditions may have been achieved by transport and injection of the core materials into a region of a partially-condensed gas that still contained refractory elements in the gas phase.

  9. Inclusion of exact exchange in the noniterative partial-differential-equation method of electron-molecule scattering - Application to e-N2

    NASA Technical Reports Server (NTRS)

    Weatherford, C. A.; Onda, K.; Temkin, A.

    1985-01-01

    The noniterative partial-differential-equation (PDE) approach to electron-molecule scattering of Onda and Temkin (1983) is modified to account for the effects of exchange explicitly. The exchange equation is reduced to a set of inhomogeneous equations containing no integral terms and solved noniteratively in a difference form; a method for propagating the solution to large values of r is described; the changes in the polarization potential of the original PDE method required by the inclusion of exact static exchange are indicated; and the results of computations for e-N2 scattering in the fixed-nuclei approximation are presented in tables and graphs and compared with previous calculations and experimental data. Better agreement is obtained using the modified PDE method.

  10. Analysis of flow near a dug well in an unconfined aquifer

    NASA Astrophysics Data System (ADS)

    Sridharan, K.; Sathyanarayana, D.; Reddy, A. Siva

    1990-11-01

    A numerical analysis of flow to a dug well in an unconfined aquifer is made, taking into account well storage, elastic storage release, gravity drainage, anisotropy, partial penetration, vertical flow and seepage surface at the well face, and treating the water table in the aquifer and water level in the well as unknown boundaries. The pumped discharge is maintained constant. The solution is obtained by a two-level iterative scheme. The effects of governing parameters on the drawdown, development of seepage surface and contribution from aquifer flow to the total discharge are discussed. The degree of anisotropy and partial penetration are found to be the parameters which affect the flow characteristics most significantly. The effect of anisotropy on the development of seepage surface is very pronounced.

  11. Annular Solar Eclipse of 10 May 1994

    NASA Technical Reports Server (NTRS)

    Espenak, Fred; Anderson, Jay

    1993-01-01

    An annular eclipse of the Sun will be widely visible from the Western Hemisphere on 10 May 1994. The path of the Moon's shadow passes through Mexico, the United States of America, maritime Canada, the North Atlantic, the Azores and Morocco. Detailed predictions for this event are presented and include tables of geographic coordinates of the annular path, local circumstances for hundreds of cities, maps of the path of annular and partial eclipse, weather prospects, and the lunar limb profile.

  12. Design and Demonstration of Automated Data Analysis Algorithms for Ultrasonic Inspection of Complex Composite Panels with Bonds

    DTIC Science & Technology

    2016-02-01

    certification process. INTRODUCTION The ultrasonic inspection of aerospace composites has been demonstrated to be one of the most effective methods to...normal part conditions. Anomalous indications studied in this program include inserted materials, porosity, ply ‘laps and gaps’, and wrinkles . Inserted...partially scanned inserts at the radii. Wrinkles , laps and gaps have also been included in the truth table, but detection rates for these flaws are

  13. 129. Photographic copy of drawing (24 June 1963, original drawing ...

    Library of Congress Historic Buildings Survey, Historic Engineering Record, Historic Landscapes Survey

    129. Photographic copy of drawing (24 June 1963, original drawing in Archives, Public Affairs Departmentm, Sears Merchandise Group, Hoffman Estates, Illinois). Swain and Meyers, Inc. 1/4 inch to one foot. Partial floor plan illustrating the layout of the large package handling area. Tables and equipment not present at the time of the survey are shown. SECOND FLOOR, SECTON B - Sears Roebuck & Company Mail Order Plant, Merchandise Building, 924 South Homan Avenue, Chicago, Cook County, IL

  14. Gleeble Testing of Tungsten Samples

    DTIC Science & Technology

    2013-02-01

    as a diffusion barrier to prevent the tungsten samples from fusing to the tungsten carbide inserts at elevated temperatures. After the anvils were...anvils with removable tungsten carbide inserts. The inserts were 19.05 mm (0.75 in) in diameter and 25.4 mm (1 in) long; they were purchased from...rhenium are shown in tables 6 and 7 and figure 7. The sample tested at 1300 °C, T4, partially embedded into the tungsten carbide (WC) inserts during

  15. Ensuring a Strong U.S. Defense for the Future: The National Defense Panel Review of the 2014 Quadrennial Defense Review

    DTIC Science & Technology

    2014-07-31

    began declining before partial sequestration, which has only worsened the problem. When automatic budget cuts took effect in April 2013 for three...structures, including the BUR force, the 2002 Force, the QDR force, and the sequestration force. Table 1 (Appendix A) contains a comparison of these...to address those same security challenges. Under the BCA, automatic reductions of the caps on Government-wide discretionary funding (sequestration

  16. Controlling Hazardous Noise and Dust within the Industrial Workforce using a Simple Barrier

    DTIC Science & Technology

    2009-03-01

    hazards, many operations still require respiratory protection. For example, a recent compilation of data showed three out of the four AF beadblast...sound shadow” (Driscoll & Royster, 2003). While full and partial enclosures have been tested in above ground mining, no published data was found to...remainder of the noise data for each position can be found at appendix A. The results of the TA measurement are shown in table 9. Due to the

  17. Computation of type curves for flow to partially penetrating wells in water-table aquifers

    USGS Publications Warehouse

    Moench, Allen F.

    1993-01-01

    Evaluation of Neuman's analytical solution for flow to a well in a homogeneous, anisotropic, water-table aquifer commonly requires large amounts of computation time and can produce inaccurate results for selected combinations of parameters. Large computation times occur because the integrand of a semi-infinite integral involves the summation of an infinite series. Each term of the series requires evaluation of the roots of equations, and the series itself is sometimes slowly convergent. Inaccuracies can result from lack of computer precision or from the use of improper methods of numerical integration. In this paper it is proposed to use a method of numerical inversion of the Laplace transform solution, provided by Neuman, to overcome these difficulties. The solution in Laplace space is simpler in form than the real-time solution; that is, the integrand of the semi-infinite integral does not involve an infinite series or the need to evaluate roots of equations. Because the integrand is evaluated rapidly, advanced methods of numerical integration can be used to improve accuracy with an overall reduction in computation time. The proposed method of computing type curves, for which a partially documented computer program (WTAQ1) was written, was found to reduce computation time by factors of 2 to 20 over the time needed to evaluate the closed-form, real-time solution.

  18. Table of superdeformed nuclear bands and fission isomers (from Nuclear Data Sheets, v.78, issue 1, May 1996)

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Singh, B.; Firestone, R B.; Chu, S Y.F.

    As part of a committment to maintain nuclear structure data as current as possible in the Evaluated Nuclear Structure Data File (ENSDF) and the Table of Isotopes, the author have been updating the information on superdeformed and hyperdeformed nuclear bands. As of February, 1996, they have compiled data for 161 superdeformed bands and 47 fission isomers identified in 93 nuclides for this publication. This is an increase of 75 superdeformed bands and 20 new nuclides since the first edition in 1994. Partial data for superdeformed bands and fission isomers are shown in the band drawings. For each nuclide there ismore » a complete level table listing both normal (taken from the ENSDF file) and superdeformed band assignments; level energy, spin, parity, half-life, magnetic moments, decay branchings; and the energies, final levels, relative intensities, multipolarities, and mixing ratios for transitions deexciting each level. Mass excess, decay energies, and proton and neutron separation energies are also provided from the evaluation of Audi and Wapstra. For superdeformed and hyperdeformed bands they provide the following quantities: level energies; level half-lives; level spins; and gamma ray energies.« less

  19. WTAQ version 2-A computer program for analysis of aquifer tests in confined and water-table aquifers with alternative representations of drainage from the unsaturated zone

    USGS Publications Warehouse

    Barlow, Paul M.; Moench, Allen F.

    2011-01-01

    The computer program WTAQ simulates axial-symmetric flow to a well pumping from a confined or unconfined (water-table) aquifer. WTAQ calculates dimensionless or dimensional drawdowns that can be used with measured drawdown data from aquifer tests to estimate aquifer hydraulic properties. Version 2 of the program, which is described in this report, provides an alternative analytical representation of drainage to water-table aquifers from the unsaturated zone than that which was available in the initial versions of the code. The revised drainage model explicitly accounts for hydraulic characteristics of the unsaturated zone, specifically, the moisture retention and relative hydraulic conductivity of the soil. The revised program also retains the original conceptualizations of drainage from the unsaturated zone that were available with version 1 of the program to provide alternative approaches to simulate the drainage process. Version 2 of the program includes all other simulation capabilities of the first versions, including partial penetration of the pumped well and of observation wells and piezometers, well-bore storage and skin effects at the pumped well, and delayed drawdown response of observation wells and piezometers.

  20. Master equation theory applied to the redistribution of polarized radiation in the weak radiation field limit. V. The two-term atom

    NASA Astrophysics Data System (ADS)

    Bommier, Véronique

    2017-11-01

    Context. In previous papers of this series, we presented a formalism able to account for both statistical equilibrium of a multilevel atom and coherent and incoherent scatterings (partial redistribution). Aims: This paper provides theoretical expressions of the redistribution function for the two-term atom. This redistribution function includes both coherent (RII) and incoherent (RIII) scattering contributions with their branching ratios. Methods: The expressions were derived by applying the formalism outlined above. The statistical equilibrium equation for the atomic density matrix is first formally solved in the case of the two-term atom with unpolarized and infinitely sharp lower levels. Then the redistribution function is derived by substituting this solution for the expression of the emissivity. Results: Expressions are provided for both magnetic and non-magnetic cases. Atomic fine structure is taken into account. Expressions are also separately provided under zero and non-zero hyperfine structure. Conclusions: Redistribution functions are widely used in radiative transfer codes. In our formulation, collisional transitions between Zeeman sublevels within an atomic level (depolarizing collisions effect) are taken into account when possible (I.e., in the non-magnetic case). However, the need for a formal solution of the statistical equilibrium as a preliminary step prevents us from taking into account collisional transfers between the levels of the upper term. Accounting for these collisional transfers could be done via a numerical solution of the statistical equilibrium equation system.

  1. Spontaneous collective synchronization in the Kuramoto model with additional non-local interactions

    NASA Astrophysics Data System (ADS)

    Gupta, Shamik

    2017-10-01

    In the context of the celebrated Kuramoto model of globally-coupled phase oscillators of distributed natural frequencies, which serves as a paradigm to investigate spontaneous collective synchronization in many-body interacting systems, we report on a very rich phase diagram in presence of thermal noise and an additional non-local interaction on a one-dimensional periodic lattice. Remarkably, the phase diagram involves both equilibrium and non-equilibrium phase transitions. In two contrasting limits of the dynamics, we obtain exact analytical results for the phase transitions. These two limits correspond to (i) the absence of thermal noise, when the dynamics reduces to that of a non-linear dynamical system, and (ii) the oscillators having the same natural frequency, when the dynamics becomes that of a statistical system in contact with a heat bath and relaxing to a statistical equilibrium state. In the former case, our exact analysis is based on the use of the so-called Ott-Antonsen ansatz to derive a reduced set of nonlinear partial differential equations for the macroscopic evolution of the system. Our results for the case of statistical equilibrium are on the other hand obtained by extending the well-known transfer matrix approach for nearest-neighbor Ising model to consider non-local interactions. The work offers a case study of exact analysis in many-body interacting systems. The results obtained underline the crucial role of additional non-local interactions in either destroying or enhancing the possibility of observing synchrony in mean-field systems exhibiting spontaneous synchronization.

  2. Energetic Coupling between Ligand Binding and Dimerization in E. coli Phosphoglycerate Mutase

    PubMed Central

    Gardner, Nathan W.; Monroe, Lyman K.; Kihara, Daisuke; Park, Chiwook

    2016-01-01

    Energetic coupling of two molecular events in a protein molecule is ubiquitous in biochemical reactions mediated by proteins, such as catalysis and signal transduction. Here, we investigate energetic coupling between ligand binding and folding of a dimer using a model system that shows three-state equilibrium unfolding in an exceptional quality. The homodimeric E. coli cofactor-dependent phosphoglycerate mutase (dPGM) was found to be stabilized by ATP in a proteome-wide screen, although dPGM does not require or utilize ATP for enzymatic function. We investigated the effect of ATP on the thermodynamic stability of dPGM using equilibrium unfolding. In the absence of ATP, dPGM populates a partially unfolded, monomeric intermediate during equilibrium unfolding. However, addition of 1.0 mM ATP drastically reduces the population of the intermediate by selectively stabilizing the native dimer. Using a computational ligand docking method, we predicted ATP binds to the active site of the enzyme using the triphosphate group. By performing equilibrium unfolding and isothermal titration calorimetry with active-site variants of dPGM, we confirmed that active-site residues are involved in ATP binding. Our findings show that ATP promotes dimerization of the protein by binding to the active site, which is distal from the dimer interface. This cooperativity suggests an energetic coupling between the active-site and the dimer interface. We also propose a structural link to explain how ligand binding to the active site is energetically coupled with dimerization. PMID:26919584

  3. Dune advance into a coastal forest, equatorial Brazil: A subsurface perspective

    NASA Astrophysics Data System (ADS)

    Buynevich, Ilya V.; Filho, Pedro Walfir M. Souza; Asp, Nils E.

    2010-06-01

    A large active parabolic dune along the coast of Pará State, northern Brazil, was analyzed using aerial photography and imaged with high-resolution ground-penetrating radar (GPR) to map the subsurface facies architecture and point-source anomalies. Most high-amplitude (8-10 dB) subsurface anomalies are correlated with partially buried mangrove trees along the leading edge (slipface) of the advancing dune. Profiles along a 200-m long basal stoss side of the dune reveal 66 targets, most of which lie below the water table and are thus inaccessible by other methods. Signal amplitudes of point-source anomalies are substantially higher than those associated with the reflections from continuous subsurface features (water table, sedimentary layers). When complemented with exposures and excavations, GPR provides the best means of rapid continuous imaging of the geological record of complex interactions between vegetation and aeolian deposition.

  4. Solution equilibrium behind the room-temperature synthesis of nanocrystalline titanium dioxide

    NASA Astrophysics Data System (ADS)

    Seisenbaeva, Gulaim A.; Daniel, Geoffrey; Nedelec, Jean-Marie; Kessler, Vadim G.

    2013-03-01

    Formation of nanocrystalline and monodisperse TiO2 from a water soluble and stable precursor, ammonium oxo-lactato-titanate, (NH4)8Ti4O4(Lactate)8.4H2O, often referred to as TiBALDH or TALH, is demonstrated to be due to a coordination equilibrium. This compound, individual in the solid state, exists in solution in equilibrium with ammonium tris-lactato-titanate, (NH4)2Ti(Lactate)3 and uniform crystalline TiO2 nanoparticles (anatase) stabilized by surface-capping with lactate ligands. This equilibrium can be shifted towards nano-TiO2via application of a less polar solvent like methanol or ethanol, dilution of the solution, introduction of salts or raising the temperature, and reverted on addition of polar and strongly solvating media such as dimethyl sulfoxide, according to NMR. Aggregation and precipitation of the particles were followed by DLS and could be achieved by a decrease in their surface charge by adsorption of strongly hydrogen-bonding cations, e.g. in solutions of ammonia, ethanolamine or amino acid arginine or by addition of ethanol. The observed equilibrium may be involved in formation of nano-titania on the surface of plant roots exerting chelating organic carboxylate ligands and thus potentially influencing plant interactions.Formation of nanocrystalline and monodisperse TiO2 from a water soluble and stable precursor, ammonium oxo-lactato-titanate, (NH4)8Ti4O4(Lactate)8.4H2O, often referred to as TiBALDH or TALH, is demonstrated to be due to a coordination equilibrium. This compound, individual in the solid state, exists in solution in equilibrium with ammonium tris-lactato-titanate, (NH4)2Ti(Lactate)3 and uniform crystalline TiO2 nanoparticles (anatase) stabilized by surface-capping with lactate ligands. This equilibrium can be shifted towards nano-TiO2via application of a less polar solvent like methanol or ethanol, dilution of the solution, introduction of salts or raising the temperature, and reverted on addition of polar and strongly solvating media such as dimethyl sulfoxide, according to NMR. Aggregation and precipitation of the particles were followed by DLS and could be achieved by a decrease in their surface charge by adsorption of strongly hydrogen-bonding cations, e.g. in solutions of ammonia, ethanolamine or amino acid arginine or by addition of ethanol. The observed equilibrium may be involved in formation of nano-titania on the surface of plant roots exerting chelating organic carboxylate ligands and thus potentially influencing plant interactions. Electronic supplementary information (ESI) available: Crystallographic data in cif and table format, detailed description of hydrogen bonding in (NH4)2[Ti(l-Lactate)3].3H2O, additional TEM images, DLS data on particle size in solutions and NanoSight data on particle size distribution, photos of produced TiO2 colloids, details of NMR experiments and a real-time movie demonstrating the equilibrium leading to TiO2 formation and re-dissolution in pH-neutral ammonium lactate solutions. CCDC 915222. For ESI and crystallographic data in CIF or other electronic format. see DOI: 10.1039/c3nr34068f

  5. First third filling parameters of left ventricle assessed from gated equilibrium studies in patients with various heart diseases

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Adatepe, M.H.; Nichols, K.; Powell, O.M.

    1984-01-01

    The authors determined the first third filling fraction (1/3 FF), the maximum filling rate (1/3 FR) and the mean filling rate (1/3 MFR) for the first third diastolic filling period of the left ventricle in patients with coronary artery disease (CAD), valvular heart disease (VHD), pericardial effusion (PE), cardiomyopathies (CM), chronic obstructive lung disease (COPD) and in 5 normals-all from resting gated equilibrium studies. Parameters are calculated from the third order Fourier fit to the LV volume curve and its derivative. 1/3 FF% = 1/3 diastolic count - end systolic count / 1/3 diastolic count x 100. Patients with CADmore » are divided into two groups: Group I with normal ejection fraction (EF) and wall motion (WM); Group II with abnormal EF and WM. Results are shown in the table. Abnormal filling parameters are found not only in CAD but in VHD, PE and CM. The authors conclude that the first third LV filling parameters are sensitive but non-specific indicators of filling abnormalities caused by diverse etiologic factors. Abnormal first third filling parameters may occur in the presence of a normal resting EF and WM in CAD.« less

  6. The Algorithm Theoretical Basis Document for Tidal Corrections

    NASA Technical Reports Server (NTRS)

    Fricker, Helen A.; Ridgway, Jeff R.; Minster, Jean-Bernard; Yi, Donghui; Bentley, Charles R.`

    2012-01-01

    This Algorithm Theoretical Basis Document deals with the tidal corrections that need to be applied to range measurements made by the Geoscience Laser Altimeter System (GLAS). These corrections result from the action of ocean tides and Earth tides which lead to deviations from an equilibrium surface. Since the effect of tides is dependent of the time of measurement, it is necessary to remove the instantaneous tide components when processing altimeter data, so that all measurements are made to the equilibrium surface. The three main tide components to consider are the ocean tide, the solid-earth tide and the ocean loading tide. There are also long period ocean tides and the pole tide. The approximate magnitudes of these components are illustrated in Table 1, together with estimates of their uncertainties (i.e. the residual error after correction). All of these components are important for GLAS measurements over the ice sheets since centimeter-level accuracy for surface elevation change detection is required. The effect of each tidal component is to be removed by approximating their magnitude using tidal prediction models. Conversely, assimilation of GLAS measurements into tidal models will help to improve them, especially at high latitudes.

  7. Table and charts of equilibrium normal-shock properties for hydrogen-helium mixtures with velocities to 70 km/sec. Volume 1: 0.95 H2-0.05 He (by volume)

    NASA Technical Reports Server (NTRS)

    Miller, C. G., III; Wilder, S. E.

    1976-01-01

    Equilibrium thermodynamic and flow properties are presented in tabulated and graphical form for moving, standing, and reflected normal shock waves into hydrogen-helium mixtures representative of postulated outer planet atmospheres. These results are presented in four volumes and the volmetric compositions of the mixtures are 0.95H2-0.05He in Volume 1, 0.90H2-0.10He in Volume 2, 0.85H2-0.15He in Volume 3, and 0.75H2-0.25He in Volume 4. Properties include pressure, temperature, density, enthalpy, speed of sound, entropy, molecular-weight ratio, isentropic exponent, velocity, and species mole fractions. Incident (moving) shock velocities are varied from 4 to 70 km/sec for a range of initial pressure of 5 N/sq m to 100 kN/sq m. Results are applicable to shock-tube flows and for determining flow conditions behind the normal portion of the bow shock about a blunt body at high velocities in postulated outer planet atmospheres. The document is a revised version of the original edition of NASA SP-3085 published in 1974.

  8. Equilibrium properties of blackbody radiation with an ultraviolet energy cut-off

    NASA Astrophysics Data System (ADS)

    Mishra, Dheeraj Kumar; Chandra, Nitin; Vaibhav, Vinay

    2017-10-01

    We study various equilibrium thermodynamic properties of blackbody radiation (i.e. a photon gas) with an ultraviolet energy cut-off. We find that the energy density, specific heat etc. follow usual acoustic phonon dynamics as have been well studied by Debye. Other thermodynamic quantities like pressure, entropy etc. have also been calculated. The usual Stefan-Boltzmann law gets modified. We observe that the values of the thermodynamic quantities with the energy cut-off is lower than the corresponding values in the theory without any such scale. The phase-space measure is also expected to get modified for an exotic spacetime appearing at Planck scale, which in turn leads to the modification of Planck energy density distribution and the Wien's displacement law. We found that the non-perturbative nature of the thermodynamic quantities in the SR limit (for both unmodified and modified cases), due to nonanalyticity of the leading term, is a general feature of the theory accompanied with an ultraviolet energy cut-off. We have also discussed the possible modification in the case of Big Bang and the Stellar objects and have suggested a table top experiment for verification in effective low energy case.

  9. Solitons of the Kadomtsev-Petviashvili equation based on lattice Boltzmann model

    NASA Astrophysics Data System (ADS)

    Wang, Huimin

    2017-01-01

    In this paper, a lattice Boltzmann model for the Kadomtsev-Petviashvili equation is proposed. By using the Chapman-Enskog expansion and the multi-scale time expansion, a series of partial differential equations in different time scales are obtained. Due to the asymmetry in x direction and y direction of the equation, the moments of the equilibrium distribution function are selected are asymmetric. The numerical results demonstrate the lattice Boltzmann method is an effective method to simulate the solitons of the Kadomtsev-Petviashvili equation.

  10. Restrictions of Non Associated Plastic Flow Laws Imposed by Thermodynamics and Uniqueness

    DTIC Science & Technology

    1986-05-20

    which have been discussed by Kestin and Rice (1970). Valanis (1971c) and Nemat-Nasser (1975b). lie in the concepts of entropy and temperature. As a...to the concept of entropy. As an example. consider the case of a rigid heat conductor in thermal equilibrium. If heat is added to the conductor, the...entropy for such systems mathematically. Using the concept of partial integrability of Pfaffian forms, Valanis finds the temperature 0 = 0(j.eL) > 0 as

  11. Thermal convection in a cylindrical enclosure

    NASA Astrophysics Data System (ADS)

    Shukla, K. N.

    2005-02-01

    The paper highlights the onset of convection in a fluid layer partially filled in an axisymmetric container. The equilibrium of the fluid is disturbed with the deformation of the interface due to residual acceleration. The general problem of deformable interface involves a dimensionless parameter, the Bond number. An analytical expression for the natural frequencies of the deformable surface is derived in terms of the Bond number, which determines the time period required for the stable location of the fluid for the propellant management of the spacecraft.

  12. Geochemistry of reduced gas related to serpentinization of the Zambales ophiolite, Philippines

    USGS Publications Warehouse

    Abrajano, T.A.; Sturchio, N.C.; Kennedy, B.M.; Lyon, G.L.; Muehlenbachs, K.; Böhlke, J.K.

    1990-01-01

    Methane-hydrogen gas seeps with mantle-like C and noble gas isotopic characteristics issue from partially serpentinized ultramafic rocks in the Zambales ophiolite, Philippines. New measurements of noble gas and 14C isotope abundances, rock/mixed-volatile equilibrium calculations, and previous chemical and isotopic data suggest that these reduced gases are products of periodotite hydration. The gas seeps are produced in rock-dominated zones of serpentinization, and similar gases may be ubiquitous in ultramafic terranes undergoing serpentinization.

  13. Invariant criteria for bound states, degree of ionization, and plasma phase transition

    NASA Technical Reports Server (NTRS)

    Girardeau, M. D.

    1990-01-01

    Basis invariant characterizations of bound states and bound fraction of a partially ionized hydrogen plasma are given in terms of properties of the spectrum of eigenvalues and eigenfunctions of the equilibrium quantum statistical one-proton-one-electron reduced density matrix. It is suggested that these can be used to place theories of a proposed plasma-ionization phase transition on a firm foundation. This general approach may be relevant to cosmological questions such as the quark deconfinement-confinement transition.

  14. An efficient and guaranteed stable numerical method for continuous modeling of infiltration and redistribution with a shallow dynamic water table

    NASA Astrophysics Data System (ADS)

    Lai, Wencong; Ogden, Fred L.; Steinke, Robert C.; Talbot, Cary A.

    2015-03-01

    We have developed a one-dimensional numerical method to simulate infiltration and redistribution in the presence of a shallow dynamic water table. This method builds upon the Green-Ampt infiltration with Redistribution (GAR) model and incorporates features from the Talbot-Ogden (T-O) infiltration and redistribution method in a discretized moisture content domain. The redistribution scheme is more physically meaningful than the capillary weighted redistribution scheme in the T-O method. Groundwater dynamics are considered in this new method instead of hydrostatic groundwater front. It is also computationally more efficient than the T-O method. Motion of water in the vadose zone due to infiltration, redistribution, and interactions with capillary groundwater are described by ordinary differential equations. Numerical solutions to these equations are computationally less expensive than solutions of the highly nonlinear Richards' (1931) partial differential equation. We present results from numerical tests on 11 soil types using multiple rain pulses with different boundary conditions, with and without a shallow water table and compare against the numerical solution of Richards' equation (RE). Results from the new method are in satisfactory agreement with RE solutions in term of ponding time, deponding time, infiltration rate, and cumulative infiltrated depth. The new method, which we call "GARTO" can be used as an alternative to the RE for 1-D coupled surface and groundwater models in general situations with homogeneous soils with dynamic water table. The GARTO method represents a significant advance in simulating groundwater surface water interactions because it very closely matches the RE solution while being computationally efficient, with guaranteed mass conservation, and no stability limitations that can affect RE solvers in the case of a near-surface water table.

  15. New Wavenumber Calibration Tables From Heterodyne Frequency Measurements

    PubMed Central

    Maki, Arthur G.; Wells, Joseph S.

    1992-01-01

    This new calibration atlas is based on frequency rather than wavelength calibration techniques for absolute references. Since a limited number of absolute frequency measurements is possible, additional data from alternate methodology are used for difference frequency measurements within each band investigated by the frequency measurements techniques. Data from these complementary techniques include the best Fourier transform measurements available. Included in the text relating to the atlas are a description of the heterodyne frequency measurement techniques and details of the analysis, including the Hamiltonians and least-squares-fitting and calculation. Also included are other relevant considerations such as intensities and lincshape parameters. A 390-entry bibliography which contains all data sources used and a subsequent section on errors conclude the text portion. The primary calibration molecules are the linear triatomics, carbonyl sulfide and nitrous oxide, which cover portions of the infrared spectrum ranging from 488 to 3120 cm−1. Some gaps in the coverage afforded by OCS and N2O are partially covered by NO, CO, and CS2. An additional region from 4000 to 4400 cm−1 is also included. The tabular portion of the atlas is too lengthy to include in an archival journal. Furthermore, different users have different requirements for such an atlas. In an effort to satisfy most users, we have made two different options available. The first is NIST Special Publication 821, which has a spectral map/facing table format. The spectral maps (as well as the facing tables) are calculated from molecular constants derived for the work. A complete list of all of the molecular transitions that went into making the maps is too long (perhaps by a factor of 4 or 5) to include in the facing tables. The second option for those not interested in maps (or perhaps to supplement Special Publication 821) is the complete list (tables-only) which is available in computerized format as NIST Standard Reference Database #39, Wavelength Calibration Tables. PMID:28053441

  16. Stochastic analysis of unsaturated steady flows above the water table

    NASA Astrophysics Data System (ADS)

    Severino, Gerardo; Scarfato, Maddalena; Comegna, Alessandro

    2017-08-01

    Steady flow takes place into a three-dimensional partially saturated porous medium where, due to their spatial variability, the saturated conductivity Ks, and the relative conductivity Kr are modeled as random space functions (RSF)s. As a consequence, the flow variables (FVs), i.e., pressure-head and specific flux, are also RSFs. The focus of the present paper consists into quantifying the uncertainty of the FVs above the water table. The simple expressions (most of which in closed form) of the second-order moments pertaining to the FVs allow one to follow the transitional behavior from the zone close to the water table (where the FVs are nonstationary), till to their far-field limit (where the FVs become stationary RSFs). In particular, it is shown how the stationary limits (and the distance from the water table at which stationarity is attained) depend upon the statistical structure of the RSFs Ks, Kr, and the infiltrating rate. The mean pressure head ><Ψ>> has been also computed, and it is expressed as <Ψ>=Ψ0>(1+ψ>), being ψ a characteristic heterogeneity function which modifies the zero-order approximation Ψ0 of the pressure head (valid for a vadose zone of uniform soil properties) to account for the spatial variability of Ks and Kr. Two asymptotic limits, i.e., close (near field) and away (far field) from the water table, are derived into a very general manner, whereas the transitional behavior of ψ between the near/far field can be determined after specifying the shape of the various input soil properties. Besides the theoretical interest, results of the present paper are useful for practical purposes, as well. Indeed, the model is tested against to real data, and in particular it is shown how it is possible for the specific case study to grasp the behavior of the FVs within an environment (i.e., the vadose zone close to the water table) which is generally very difficult to access by direct inspection.

  17. Defining constants, equations, and abbreviated tables of the 1975 US Standard Atmosphere

    NASA Technical Reports Server (NTRS)

    Minzner, R. A.; Reber, C. A.; Jacchia, L. G.; Huang, F. T.; Cole, A. E.; Kantor, A. J.; Keneshea, T. J.; Zimmerman, S. P.; Forbes, J. M.

    1976-01-01

    The U.S. Standard Atmosphere, 1975 (COESA, 1975) is an idealized, steady-state representation of the earth's atmosphere from the surface of the earth to 1000-km altitude, as it is assumed to exist in a period of moderate solar activity. From 0 to 86 km, the atmospheric model is specified in terms of the hydrostatic equilibrium of a perfect gas, with that portion of the model from 0 to 51 geopotential kilometers being identical with that of the U.S. Standard Atmosphere, 1962 (COESA, 1962). Between 51 and 86 km, the defining temperature-height profile has been modified from that of the 1962 Standard to lower temperatures between 51 and 69.33 km, and to greater values between 69.33 and 86 km. Above 86 km, the model is defined in terms of quasi-dynamic considerations involving the vertical component of the flux of molecules of individual gas species. These conditions lead to the generation of independent number-density distributions of the major species, N2, O2, O, Ar, Ne, and H, consistent with observations. The detailed definitions of the model are presented along with graphs and abbreviated tables of the atmospheric properties of the 1975 Standard.

  18. Astrophysical fluid simulations of thermally ideal gases with non-constant adiabatic index: numerical implementation

    NASA Astrophysics Data System (ADS)

    Vaidya, B.; Mignone, A.; Bodo, G.; Massaglia, S.

    2015-08-01

    Context. An equation of state (EoS) is a relation between thermodynamic state variables and it is essential for closing the set of equations describing a fluid system. Although an ideal EoS with a constant adiabatic index Γ is the preferred choice owing to its simplistic implementation, many astrophysical fluid simulations may benefit from a more sophisticated treatment that can account for diverse chemical processes. Aims: In the present work we first review the basic thermodynamic principles of a gas mixture in terms of its thermal and caloric EoS by including effects like ionization, dissociation, and temperature dependent degrees of freedom such as molecular vibrations and rotations. The formulation is revisited in the context of plasmas that are either in equilibrium conditions (local thermodynamic- or collisional excitation-equilibria) or described by non-equilibrium chemistry coupled to optically thin radiative cooling. We then present a numerical implementation of thermally ideal gases obeying a more general caloric EoS with non-constant adiabatic index in Godunov-type numerical schemes. Methods: We discuss the necessary modifications to the Riemann solver and to the conversion between total energy and pressure (or vice versa) routinely invoked in Godunov-type schemes. We then present two different approaches for computing the EoS. The first employs root-finder methods and it is best suited for EoS in analytical form. The second is based on lookup tables and interpolation and results in a more computationally efficient approach, although care must be taken to ensure thermodynamic consistency. Results: A number of selected benchmarks demonstrate that the employment of a non-ideal EoS can lead to important differences in the solution when the temperature range is 500-104 K where dissociation and ionization occur. The implementation of selected EoS introduces additional computational costs although the employment of lookup table methods (when possible) can significantly reduce the overhead by a factor of ~ 3-4.

  19. Modeling Paragenesis: Erosion Opposite to Gravity in Cave Channels

    NASA Astrophysics Data System (ADS)

    Cooper, M. P.; Covington, M. D.

    2017-12-01

    Sediment plays an important role in bedrock channels, providing both tools and cover that influence patterns of bed erosion. It has also been shown that sediment load influences bedrock channel width, with increased sediment leading to wider channels. A variety of models have been developed to explore these effects. In caves, it is hypothesized that sediments covering the floors of fully flooded channels that are forming beneath the water table (phreatic zone) can force dissolution upwards towards the water table, leading to upward erosion balanced by gradual deposition of sediment within the channel bottom. This strange process is termed paragenesis, and while there are conceptual and experimental models of the process, no prior mathematical models of cave passage evolution has captured these effects. Consequently, there is little quantitative understanding of the processes that drive paragenesis and how they link to the morphology of the cave channels that develop. We adapt a previously developed algorithm for estimating boundary shear stress within channels with free-surface flows to enable calculation of boundary shear stress in pipe-full conditions. This model successfully duplicates scaling relationships in surface channels, and geometries of caves formed in the phreatic zone such as phreatic tubes. Once sediment flux is incorporated the model successfully duplicates the hypothesized processes of paragenetic gallery formation: the cover effect prevents dissolution in the direction of gravity; passages are enlarged upwards reducing the sediment transport capacity; sediment is deposited and the process drives a continuing feedback loop. Simulations reveal that equilibrium paragenetic channel widths scale with both sediment flux and discharge. Unlike in open channel settings, increased sediment load actually narrows paragenetic channels. The cross section evolution model also reveals that the existence of equilibrium widths in such galleries requires erosion to scale with shear stress, suggesting a role of either mechanical erosion or transport limited dissolution. These types of erosion contrast with current numerical models of speleogenesis, where chemically limited dissolution, a process independent of shear stress, is predicted to occur in most turbulent flow settings.

  20. Addressing the identification problem in age-period-cohort analysis: a tutorial on the use of partial least squares and principal components analysis.

    PubMed

    Tu, Yu-Kang; Krämer, Nicole; Lee, Wen-Chung

    2012-07-01

    In the analysis of trends in health outcomes, an ongoing issue is how to separate and estimate the effects of age, period, and cohort. As these 3 variables are perfectly collinear by definition, regression coefficients in a general linear model are not unique. In this tutorial, we review why identification is a problem, and how this problem may be tackled using partial least squares and principal components regression analyses. Both methods produce regression coefficients that fulfill the same collinearity constraint as the variables age, period, and cohort. We show that, because the constraint imposed by partial least squares and principal components regression is inherent in the mathematical relation among the 3 variables, this leads to more interpretable results. We use one dataset from a Taiwanese health-screening program to illustrate how to use partial least squares regression to analyze the trends in body heights with 3 continuous variables for age, period, and cohort. We then use another dataset of hepatocellular carcinoma mortality rates for Taiwanese men to illustrate how to use partial least squares regression to analyze tables with aggregated data. We use the second dataset to show the relation between the intrinsic estimator, a recently proposed method for the age-period-cohort analysis, and partial least squares regression. We also show that the inclusion of all indicator variables provides a more consistent approach. R code for our analyses is provided in the eAppendix.

  1. DOE Office of Scientific and Technical Information (OSTI.GOV)

    Fontes, Christopher J.; Zhang, Hong Lin

    We calculated relativistic distorted-wave collision strength for all possible Δn=0 transitions, where n denotes the valence shell of the ground level, in the 67 Li-like, F-like and Na-like ions with Z in the range 26 ≤ Z ≤92. This choice produces 3 transitions with n=2 in the Li-like and F-like ions, and 10 transitions with n=3 in the Na-like ions. Moreover, for the Li-like and F-like ions, the calculations were made for the six final, or scattered, electron energies E'=0.008,0.04,0.10,0.21,0.41, and 0.75, where E' is in units of Zmore » $$2\\atop{eff}$$ Ry with Z eff = Z- 1.66 for Li-like ions and Z eff= Z- 6.667 for F-like ions. For the Na-like ions, the calculations were made for the six final electron energies E'=0.0025,0.015,0.04,0.10,0.21, and 0.40, with Z eff = Z- 8.34. In the present calculations, an improved “top-up” method, which employs relativistic plane waves, was used to obtain the high partial-wave contribution for each transition, in contrast to the partial-relativistic Coulomb–Bethe approximation used in previous works by Zhang, Sampson and Fontes [H.L. Zhang, D.H. Sampson, C.J. Fontes, At. Data Nucl. Data Tables 44 (1990) 31; H.L. Zhang, D.H. Sampson, C.J. Fontes, At. Data Nucl. Data Tables 48 (1991) 25; D.H. Sampson, H.L. Zhang, C.J. Fontes, At. Data Nucl. Data Tables 44 (1990) 209]. In those previous works, collision strengths were also provided for Li-, F- and Na-like ions, but for a more comprehensive set of transitions. Finally, the collision strengths covered in the present work should be more accurate than the corresponding data given in those previous works and are presented here to replace those earlier results.« less

  2. Methodological review: measured and reported congruence between preferred and actual place of death.

    PubMed

    Bell, C L; Somogyi-Zalud, E; Masaki, K H

    2009-09-01

    Congruence between preferred and actual place of death is an important palliative care outcome reported in the literature. We examined methods of measuring and reporting congruence to highlight variations impairing cross-study comparisons. Medline, PsychInfo, CINAHL, and Web of Science were systematically searched for clinical research studies examining patient preference and congruence as an outcome. Data were extracted into a matrix, including purpose, reported congruence, and method for eliciting preference. Studies were graded for quality. Using tables of preferred versus actual places of death, an overall congruence (total met preferences out of total preferences) and a kappa statistic of agreement were determined for each study. Twelve studies were identified. Percentage of congruence was reported using four different definitions. Ten studies provided a table or partial table of preferred versus actual deaths for each place. Three studies provided kappa statistics. No study achieved better than moderate agreement when analysed using kappa statistics. A study which elicited ideal preference reported the lowest agreement, while longitudinal studies reporting final preferred place of death yielded the highest agreement (moderate agreement). Two other studies of select populations also yielded moderate agreement. There is marked variation in methods of eliciting and reporting congruence, even among studies focused on congruence as an outcome. Cross-study comparison would be enhanced by the use of similar questions to elicit preference, tables of preferred versus actual places of death, and kappa statistics of agreement.

  3. Investigation of uranium plasma emission from 1050 to 6000 A

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Mack, J.M. Jr.

    1977-12-01

    Absolute emission coefficient measurements on arc-generated uranium plasmas in local thermodynamic equilibrium are described for a wavelength bandwidth of 1050 to 6000A. Low- and high-pressure arcs were investigated for their emission properties, characteristic temperatures and uranium partial pressures. Temperatures from 5500 to 8000 K and uranium partial pressures from 0.001 to 0.01 atm were found at the arc centerline. The new emission data are compared with other similar experimental results and to existing theoretical calculations. The effects of cold-layer UF/sub 6/ photoabsorption on uranium plasma emission characteristics are established for UF/sub 6/ molecular densities ranging from 1.0 x 10/sup 16/more » to 1.0 x 10/sup 17/ cm/sup -3/ and layer thickness from 1.0 to 5.0 cm.« less

  4. Humidity influence on gas-particle phase partitioning of α-pinene + O3 secondary organic aerosol

    NASA Astrophysics Data System (ADS)

    Prisle, N. L.; Engelhart, G. J.; Bilde, M.; Donahue, N. M.

    2010-01-01

    Water vapor uptake to particles could potentially affect organic-aerosol mass in three ways: first, water in the organic phase could reduce organic (equilibrium) partial pressures according to Raoult's law; second, an aqueous phase could attract water soluble organics according to Henry's law; finally, deliquescence of inorganic particle cores could mix the organic and inorganic particle phases, significantly diluting the organics and again reducing organic partial pressures according to Raoult's law. We present experiments using initially dry α-pinene + ozone secondary organic aerosol (SOA) on ammonium sulfate (AS) seeds at atmospheric concentrations in a smog chamber. After SOA formation, the chamber relative humidity is increased steadily by addition of steam to near 100%. Little subsequent SOA mass growth is observed, suggesting that none of these potential effects play a strong role in this system.

  5. Thermodynamic models for bounding pressurant mass requirements of cryogenic tanks

    NASA Technical Reports Server (NTRS)

    Vandresar, Neil T.; Haberbusch, Mark S.

    1994-01-01

    Thermodynamic models have been formulated to predict lower and upper bounds for the mass of pressurant gas required to pressurize a cryogenic tank and then expel liquid from the tank. Limiting conditions are based on either thermal equilibrium or zero energy exchange between the pressurant gas and initial tank contents. The models are independent of gravity level and allow specification of autogenous or non-condensible pressurants. Partial liquid fill levels may be specified for initial and final conditions. Model predictions are shown to successfully bound results from limited normal-gravity tests with condensable and non-condensable pressurant gases. Representative maximum collapse factor maps are presented for liquid hydrogen to show the effects of initial and final fill level on the range of pressurant gas requirements. Maximum collapse factors occur for partial expulsions with large final liquid fill fractions.

  6. Fragmentation of Solid Materials Using Shock Tubes. Part 2: First Test Series in a Large Diameter Shock Tube

    DTIC Science & Technology

    2017-12-01

    description in Figure 9 below 2 Full or partial loss of test data due to instrumentation/triggering failures 3 Gages not included in these tests 4...Table 2. Sample properties. Test Description Dimensions Weight (lbs.) Strength (psi) Notes 17 Fully Tempered Glass Window 4-ft x 6-ft x...an estimate of prism strength for medium weight CMU. The reinforced concrete sample was a 5.5-in thick solid panel. To evaluate its strength

  7. Holographic Scaling and Dynamical Gauge Effects in Disordered Atomic Gases

    NASA Astrophysics Data System (ADS)

    Gemelke, Nathan

    2016-05-01

    Quantum systems with strong disorder, and those far from equilibrium or interacting with a thermal reservior, present unique challenges in a range of physical contexts, from non-relativistic condensed-matter settings, such as in study of localization phenomena, to relativistic cosmology and the study of fundamental interactions. Recently, two related concepts, that of the entropy of entanglement, and the controversial suggestion of entropic emergent gravity, have shed insight on several long-standing questions along these lines, suggesting that strongly disordered systems with causal barriers (either relativistic or those with Lieb-Robinson-like bounds) can be understood using holographic principles in combination with the equivalence between quantum vacuua thermal baths via the Unruh effect. I will discuss a range of experiments performed within a strong, topologically disordered medium for neutral atoms which simultaneously introduces quenched disorder for spin and mass transport, and provides simple mechanisms for open coupling to various types of dissipative baths. Under conditions in which a subset of quantum states are continuously decoupled from the thermal bath, dark state effects lead to slow light phenomena mimicking gravitational lensing in general relativity in a characterizable table-top disordered medium. Non-equilibrium steady-states are observed in direct analogy with the evaporation of gravitational singularities, and we observe scaling behaviors that can be directly connected to holographic measures of the information contained in disorder. Finally, I will show how a dynamic-gauge-field picture of this and similar systems can lead to a natural description of non-equilibrium and disordered phenomena, and how it provides some advantages over the Harris and Luck criteria for describing critical phenomena. Connections between out-of-equilibrium dynamics and some long-unresolved issues concerning the existence of a gauge-boson mass gap in certain Yang-Mills models will also be discussed, as will dynamic gauge effects in experimental many-body systems. This work was supported by NSF Award Number 1068570, and a Grant from the Charles E. Kaufman Foundation.

  8. Super heavy element Copernicium: Cohesive and electronic properties revisited

    NASA Astrophysics Data System (ADS)

    Gyanchandani, Jyoti; Mishra, Vinayak; Dey, G. K.; Sikka, S. K.

    2018-01-01

    First principles scalar relativistic (SR) calculations with and without including the spin orbit (SO) interactions have been performed for solid Copernicium (Cn) to determine its ground state equilibrium structure, volume, bulk modulus, pressure derivative of the bulk modulus, density of states and band structure. Both SR and SR+SO calculations have been performed with 6p levels treated as part of core electrons and also as part of valence electrons. These calculations have been performed for the rhombohedral, BCT, FCC, HCP, BCC and SC structures. Results have been compared with the results for Hg which is lighter homologue of Cn in the periodic table. We find hcp to be the stable crystal structure at SR level of theory and also at SR+SO level of theory when the 6p electrons are treated as part of core electrons. With 6p as part of valence electrons, SR+SO level of computations, however, yield bcc structure to be the most stable structure. Equilibrium volume (V0) of the most stable crystal structure at SR level of theory viz. hcp structure is 188.66 a.u.3whereas its value for the bcc structure, the equilibrium ground state structure at SR+SO level of theory is 165.71 a.u.3 i.e a large change due to relativistic effects is seen. The density of states at Fermi level is much smaller in Cn than in Hg, making it a poorer metal than mercury. In addition the cohesive energy of Cn is computed to be almost two times that of Hg for SR+SO case.

  9. Modeling tritium transport through a deep unsaturated zone in an arid environment

    USGS Publications Warehouse

    Mayers, C.J.; Andraski, Brian J.; Cooper, C.A.; Wheatcraft, S.W.; Stonestrom, David A.; Michel, R.L.

    2005-01-01

    Understanding transport of tritium (3H) in unsaturated zones is critical to evaluating options for waste isolation. Tritium typically is a large component of low-level radioactive waste (LLRW). Studies at the U.S. Geological Survey's Amargosa Desert Research Site (ADRS) in Nevada investigate 3H transport from a closed LLRW facility. Two boreholes are 100 and 160 m from the nearest waste trench and extend to the water table at 110 m. Soil-water vapor samples from the deep boreholes show elevated levels of 3H at all depths. The objectives of this study were to (i) test source thermal and gas-advection mechanisms driving 3H transport and (ii) evaluate model sensitivity to these mechanisms and to selected physical and hydraulic properties including porosity, tortuosity, and anisotropy. A two-dimensional numerical model incorporated a non-isothermal, heterogeneous domain of the unsaturated zone and instantaneous isotopic equilibrium. The TOUGH2 code was used; however, it required modification to account for temperature dependence of both the Henry's law equilibrium constant and isotopic fractionation with respect to tritiated water. Increases in source temperature, pressure, and porosity enhanced 3H migration, but failed to match measured 3H distributions. All anisotropic simulations with a source pressure component resembled, in shape, the upper portion of the 3H distribution of the nearest borehole. Isotopic equilibrium limited migration of 3H, while effects of radioactive decay were negligible. A 500 Pa pressure increase above ambient pressure in conjunction with a high degree of anisotropy (1:100) was necessary for simulated 3H transport to reach the nearest borehole.

  10. 1/f noise: diffusive systems and music

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Voss, R.F.

    1975-11-01

    Measurements of the 1/f voltage noise in continuous metal films are reported. At room temperature, samples of pure metals and bismuth (with a carrier density smaller by 10/sup 5/) of similar volume had comparable noise. The results suggest that the noise arises from equilibrium temperature fluctuations modulating the resistance. Spatial correlation of the noise implied that the fluctuations obey a diffusion equation. The empirical inclusion of an explicit 1/f region and appropriate normalization lead to excellent agreement with the measured noise. If the fluctuations are assumed to be spatially correlated, the diffusion equation can yield an extended 1/f region inmore » the power spectrum. The temperature response of a sample to delta and step function power inputs is shown to have the same shape as the autocorrelation function for uncorrelated and correlated temperature fluctuations, respectively. The spectrum obtained from the cosine transform of the measured step function response is in excellent agreement with the measured 1/f voltage noise spectrum. Spatially correlated equilibrium temperature fluctuations are not the dominant source of 1/f noise in semiconductors and metal films. However, the agreement between the low-frequency spectrum of fluctuations in the mean-square Johnson noise voltage and the resistance fluctuation spectrum measured in the presence of a current demonstrates that in these systems the 1/f noise is also due to equilibrium resistance fluctuations. Loudness fluctuations in music and speech and pitch fluctuations in music also show the 1/f behavior. 1/f noise sources, consequently, are demonstrated to be the natural choice for stochastic composition. 26 figures, 1 table. (auth)« less

  11. Infinitely Dilute Partial Molar Properties of Proteins from Computer Simulation

    PubMed Central

    2015-01-01

    A detailed understanding of temperature and pressure effects on an infinitely dilute protein’s conformational equilibrium requires knowledge of the corresponding infinitely dilute partial molar properties. Established molecular dynamics methodologies generally have not provided a way to calculate these properties without either a loss of thermodynamic rigor, the introduction of nonunique parameters, or a loss of information about which solute conformations specifically contributed to the output values. Here we implement a simple method that is thermodynamically rigorous and possesses none of the above disadvantages, and we report on the method’s feasibility and computational demands. We calculate infinitely dilute partial molar properties for two proteins and attempt to distinguish the thermodynamic differences between a native and a denatured conformation of a designed miniprotein. We conclude that simple ensemble average properties can be calculated with very reasonable amounts of computational power. In contrast, properties corresponding to fluctuating quantities are computationally demanding to calculate precisely, although they can be obtained more easily by following the temperature and/or pressure dependence of the corresponding ensemble averages. PMID:25325571

  12. Effects of Climate on Co-evolution of Weathering Profiles and Hillscapes

    NASA Astrophysics Data System (ADS)

    Anderson, R. S.; Rajaram, H.; Anderson, S. P.

    2017-12-01

    Considerable debate revolves around the relative importance of rock type, tectonics, and climate in creating the architecture of the critical zone. It has recently been proposed that differences in the depths and patterns of weathering between landscapes in Colorado's Front Range and South Carolina's piedmont can be attributed to the state of stress in the rock imposed by the magnitude and orientation the regional stresses with respect to the ridgelines (St. Claire et al., 2016). We argue for the importance of the climate, and in particular, in temperate regions, the amount of recharge. We employ numerical models of hillslope evolution between bounding erosional channels, in which the degree of rock weathering governs the rate of transformation of rock to soil. As the water table drapes between the stream channels, fresh rock is brought into the weathering zone at a rate governed by the rate of incision of the channels. We track the chemical weathering of rock, represented by alteration of feldspar to clays, which in turn requires calculation of the concentration of reactive species in the water along hydrologic flow paths. We present results from analytic solutions to the flow field in which travel times can be efficiently assessed. Below the water table, flow paths are hyperbolic, taking on considerable lateral components as they veer toward the bounding channels that serve as drains to the hillslope. We find that if water is far from equilibrium with respect to weatherable minerals at the water table, as occurs in wet, slowly-eroding landscapes, deep weathering can occur well below the water table to levels approximating the base of the bounding channels. In dry climates, on the other hand, the weathering zone is limited to a shallow surface - parallel layer. These models capture the essence of the observed differences in depth to fresh rock in both wet and dry climates without appeal to the state of stress in the rock.

  13. Privacy-preserving genome-wide association studies on cloud environment using fully homomorphic encryption

    PubMed Central

    2015-01-01

    Objective Developed sequencing techniques are yielding large-scale genomic data at low cost. A genome-wide association study (GWAS) targeting genetic variations that are significantly associated with a particular disease offers great potential for medical improvement. However, subjects who volunteer their genomic data expose themselves to the risk of privacy invasion; these privacy concerns prevent efficient genomic data sharing. Our goal is to presents a cryptographic solution to this problem. Methods To maintain the privacy of subjects, we propose encryption of all genotype and phenotype data. To allow the cloud to perform meaningful computation in relation to the encrypted data, we use a fully homomorphic encryption scheme. Noting that we can evaluate typical statistics for GWAS from a frequency table, our solution evaluates frequency tables with encrypted genomic and clinical data as input. We propose to use a packing technique for efficient evaluation of these frequency tables. Results Our solution supports evaluation of the D′ measure of linkage disequilibrium, the Hardy-Weinberg Equilibrium, the χ2 test, etc. In this paper, we take χ2 test and linkage disequilibrium as examples and demonstrate how we can conduct these algorithms securely and efficiently in an outsourcing setting. We demonstrate with experimentation that secure outsourcing computation of one χ2 test with 10, 000 subjects requires about 35 ms and evaluation of one linkage disequilibrium with 10, 000 subjects requires about 80 ms. Conclusions With appropriate encoding and packing technique, cryptographic solutions based on fully homomorphic encryption for secure computations of GWAS can be practical. PMID:26732892

  14. Temporal dynamics of groundwater-dissolved inorganic carbon beneath a drought-affected braided stream: Platte River case study

    NASA Astrophysics Data System (ADS)

    Boerner, Audrey R.; Gates, John B.

    2015-05-01

    Impacts of environmental changes on groundwater carbon cycling are poorly understood despite their potentially high relevance to terrestrial carbon budgets. This study focuses on streambed groundwater chemistry during a period of drought-induced river drying and consequent disconnection between surface water and groundwater. Shallow groundwater underlying vegetated and bare portions of a braided streambed in the Platte River (Nebraska, USA) was monitored during drought conditions in summer 2012. Water temperature and dissolved inorganic carbon (dominated by HCO3-) in streambed groundwater were correlated over a 3 month period coinciding with a decline in river discharge from 35 to 0 m3 s-1. Physical, chemical, and isotopic parameters were monitored to investigate mechanisms affecting the HCO3- trend. Equilibrium thermodynamic modeling suggests that an increase of pCO2 near the water table, coupled with carbonate mineral weathering, can explain the trend. Stronger temporal trends in Ca2+ and Mg2+ compared to Cl- are consistent with carbonate mineral reequilibria rather than evaporative concentration as the primary mechanism of the increased HCO3-. Stable isotope trends are not apparent, providing further evidence of thermodynamic controls rather than evaporation from the water table. A combination of increased temperature and O2 in the dewatered portion of the streambed is the most likely driver of increased pCO2 near the water table. Results of this study highlight potential linkages between surface environmental changes and groundwater chemistry and underscore the need for high-resolution chemical monitoring of alluvial groundwater in order to identify environmental change impacts.

  15. DOE Office of Scientific and Technical Information (OSTI.GOV)

    Simunovic, Srdjan; Piro, Markus H.A.

    Thermochimica is a software library that determines a unique combination of phases and their compositions at thermochemical equilibrium. Thermochimica can be used for stand-alone calculations or it can be directly coupled to other codes. This release of the software does not have a graphical user interface (GUI) and it can be executed from the command line or from an Application Programming Interface (API). Also, it is not intended for thermodynamic model development or for constructing phase diagrams. The main purpose of the software is to be directly coupled with a multi-physics code to provide material properties and boundary conditions formore » various physical phenomena. Significant research efforts have been dedicated to enhance computational performance through advanced algorithm development, such as improved estimation techniques and non-linear solvers. Various useful parameters can be provided as output from Thermochimica, such as: determination of which phases are stable at equilibrium, the mass of solution species and phases at equilibrium, mole fractions of solution phase constituents, thermochemical activities (which are related to partial pressures for gaseous species), chemical potentials of solution species and phases, and integral Gibbs energy (referenced relative to standard state). The overall goal is to provide an open source computational tool to enhance the predictive capability of multi-physics codes without significantly impeding computational performance.« less

  16. The V122I cardiomyopathy variant of transthyretin increases the velocity of rate-limiting tetramer dissociation, resulting in accelerated amyloidosis

    PubMed Central

    Jiang, Xin; Buxbaum, Joel N.; Kelly, Jeffery W.

    2001-01-01

    The transthyretin (TTR) amyloid diseases are of keen interest, because there are >80 mutations that cause, and a few mutations that suppress, disease. The V122I variant is the most common amyloidogenic mutation worldwide, producing familial amyloidotic cardiomyopathy primarily in individuals of African descent. The substitution shifts the tetramer-folded monomer equilibrium toward monomer (lowers tetramer stability) and lowers the kinetic barrier associated with rate-limiting tetramer dissociation (pH 7; relative to wild-type TTR) required for amyloid fibril formation. Fibril formation is also accelerated because the folded monomer resulting from the tetramer-folded monomer equilibrium rapidly undergoes partial denaturation and self-assembles into amyloid (in vitro) when subjected to a mild denaturation stress (e.g., pH 4.8). Incorporation of the V122I mutation into a folded monomeric variant of transthyretin reveals that this mutation does not destabilize the tertiary structure or alter the rate of amyloidogenesis relative to the wild-type monomer. The increase in the velocity of rate-limiting tetramer dissociation coupled with the lowered tetramer stability (increasing the mol fraction of folded monomer present at equilibrium) may explain why V122I confers an apparent absolute anatomic risk for cardiac amyloid deposition. PMID:11752443

  17. Nonequilibrium Kondo effect by the equilibrium numerical renormalization group method: The hybrid Anderson model subject to a finite spin bias

    NASA Astrophysics Data System (ADS)

    Fang, Tie-Feng; Guo, Ai-Min; Sun, Qing-Feng

    2018-06-01

    We investigate Kondo correlations in a quantum dot with normal and superconducting electrodes, where a spin bias voltage is applied across the device and the local interaction U is either attractive or repulsive. When the spin current is blockaded in the large-gap regime, this nonequilibrium strongly correlated problem maps into an equilibrium model solvable by the numerical renormalization group method. The Kondo spectra with characteristic splitting due to the nonequilibrium spin accumulation are thus obtained at high precision. It is shown that while the bias-induced decoherence of the spin Kondo effect is partially compensated by the superconductivity, the charge Kondo effect is enhanced out of equilibrium and undergoes an additional splitting by the superconducting proximity effect, yielding four Kondo peaks in the local spectral density. In the charge Kondo regime, we find a universal scaling of charge conductance in this hybrid device under different spin biases. The universal conductance as a function of the coupling to the superconducting lead is peaked at and hence directly measures the Kondo temperature. Our results are of direct relevance to recent experiments realizing a negative-U charge Kondo effect in hybrid oxide quantum dots [Nat. Commun. 8, 395 (2017), 10.1038/s41467-017-00495-7].

  18. Spinel-olivine-pryoxene equilibrium iron isotopic fractionation and applications to natural peridotites

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Roskosz, Mathieu; Sio, Corliss K. I.; Dauphas, Nicolas

    2015-11-15

    Eight spinel-group minerals were synthesized by a flux-growth method producing spinels with varying composition and Fe3+/Fe-tot ratios. The mean force constants of iron bonds in these minerals were determined by synchrotron nuclear resonant inelastic X-ray scattering (NRIXS) in order to determine the reduced isotopic partition function ratios (beta-factors) of these spinels. The mean force constants are strongly dependent on the Fe3+/Fe-tot of the spinel but are independent, or weakly dependent on other structural and compositional parameters. From our spectroscopic data, it is found that a single redox-dependent calibration line accounts for the effects of Fe3+/Fe-tot on the beta-factors of spinels.more » This calibration successfully describes the equilibrium Fe isotopes fractionation factors between spinels and silicates (olivine and pyroxenes). Our predictions are in excellent agreement with independent determinations for the equilibrium Fe isotopic fractionations for the magnetite- fayalite and the magnetite-hedenbergite couples. Our calibration applies to the entire range of Fe3+/Fe-tot ratios found in natural spinels and provides a basis for interpreting iron isotopic variations documented in mantle peridotites. Except for a few exceptions, most of the samples measured so far are in isotopic disequilibrium, reflecting metasomatism and partial melting processes.« less

  19. Origin, evolution, and population genetics of the selfish Segregation Distorter gene duplication in European and African populations of Drosophila melanogaster.

    PubMed

    Brand, Cara L; Larracuente, Amanda M; Presgraves, Daven C

    2015-05-01

    Meiotic drive elements are a special class of evolutionarily "selfish genes" that subvert Mendelian segregation to gain preferential transmission at the expense of homologous loci. Many drive elements appear to be maintained in populations as stable polymorphisms, their equilibrium frequencies determined by the balance between drive (increasing frequency) and selection (decreasing frequency). Here we show that a classic, seemingly balanced, drive system is instead characterized by frequent evolutionary turnover giving rise to dynamic, rather than stable, equilibrium frequencies. The autosomal Segregation Distorter (SD) system of the fruit fly Drosophila melanogaster is a selfish coadapted meiotic drive gene complex in which the major driver corresponds to a partial duplication of the gene Ran-GTPase activating protein (RanGAP). SD chromosomes segregate at similar, low frequencies of 1-5% in natural populations worldwide, consistent with a balanced polymorphism. Surprisingly, our population genetic analyses reveal evidence for parallel, independent selective sweeps of different SD chromosomes in populations on different continents. These findings suggest that, rather than persisting at a single stable equilibrium, SD chromosomes turn over frequently within populations. © 2015 The Author(s). Evolution published by Wiley Periodicals, Inc. on behalf of The Society for the Study of Evolution.

  20. Fate and transport with material response characterization of green sorption media for copper removal via desorption process.

    PubMed

    Chang, Ni-Bin; Houmann, Cameron; Lin, Kuen-Song; Wanielista, Martin

    2016-07-01

    Multiple adsorption and desorption cycles are required to achieve the reliable operation of copper removal and recovery. A green sorption media mixture composed of recycled tire chunk, expanded clay aggregate, and coconut coir was evaluated in this study for its desorptive characteristics as a companion study of the corresponding adsorption process in an earlier publication. We conducted a screening of potential desorbing agents, batch desorption equilibrium and kinetic studies, and batch tests through 3 adsorption/desorption cycles. The desorbing agent screening revealed that hydrochloric acid has good potential for copper desorption. Equilibrium data fit the Freundlich isotherm, whereas kinetic data had high correlation with the Lagergren pseudo second-order model and revealed a rapid desorption reaction. Batch equilibrium data over 3 adsorption/desorption cycles showed that the coconut coir and media mixture were the most resilient, demonstrating they could be used through 3 or more adsorption/desorption cycles. FE-SEM imaging, XRD, and EDS analyses supported the batch adsorption and desorption results showing significant surface sorption of CuO species in the media mixture and coconut coir, followed by partial desorption using 0.1 M HCl as a desorbing agent. Copyright © 2016 Elsevier Ltd. All rights reserved.

  1. Equiparatition of energy for turbulent astrophysical fluids: Accounting for the unseen energy in molecular clouds

    NASA Technical Reports Server (NTRS)

    Zweibel, Ellen G.; Mckee, Christopher F.

    1995-01-01

    Molecular clouds are observed to be partially supported by turbulent pressure. The kinetic energy of the turbulence is directly measurable, but the potential energy, which consists of magnetic, thermal, and gravitational potential energy, is largly unseen. We have extended previous results on equipartition between kinetic and potential energy to show that it is likely to be a very good approximation in molecular clouds. We have used two separate approaches to demonstrate this result: For small-amplitude perturbations of a static equilibrium, we have used the energy principle analysis of Bernstein et al. (1958); this derivation applies to perturbations of arbitary wavelength. To treat perturbations of a nonstatic equilibrium, we have used the Lagrangian analysis of Dewar (1970); this analysis applies only to short-wavelength perturbations. Both analysis assume conservation of energy. Wave damping has only a small effect on equipartition if the wave frequency is small compared to the neutral-ion collision frequency; for the particular case we considered, radiative losses have no effect on equipartition. These results are then incorporated in a simple way into analyses of cloud equilibrium and global stability. We discuss the effect of Alfvenic turbulence on the Jeans mass and show that it has little effect on the magnetic critical mass.

  2. Heat capacities and thermodynamic functions for beryl, Be3Al2Si6O18, phenakite, Be2SiO4, euclase, BeAlSiO4(OH), bertrandite, Be4Si2O7(OH)2, and chrysoberyl, BeAl2O4.

    USGS Publications Warehouse

    Hemingway, B.S.; Barton, M.D.; Robie, R.A.; Haselton, H.T.

    1986-01-01

    The heat capacities of beryl, phenakite, euclase and bertrandite have been measured between approx 5 and 800 K by combined quasi-adiabatic cryogenic calorimetry and differential scanning calorimetry. The heat capacities of chrysoberyl have been measured from 340 to 800 K. The resulting data have been combined with solution and phase-equilibrium experimental data and simultaneously adjusted using the programme PHAS20 to provide an internally consistent set of thermodynamic properties for several important beryllium phases. The experimental heat capacities and tables of derived thermodynamic properties are presented.-J.A.Z.

  3. ThermoBuild: Online Method Made Available for Accessing NASA Glenn Thermodynamic Data

    NASA Technical Reports Server (NTRS)

    McBride, Bonnie; Zehe, Michael J.

    2004-01-01

    The new Web site program "ThermoBuild" allows users to easily access and use the NASA Glenn Thermodynamic Database of over 2000 solid, liquid, and gaseous species. A convenient periodic table allows users to "build" the molecules of interest and designate the temperature range over which thermodynamic functions are to be displayed. ThermoBuild also allows users to build custom databases for use with NASA's Chemical Equilibrium with Applications (CEA) program or other programs that require the NASA format for thermodynamic properties. The NASA Glenn Research Center has long been a leader in the compilation and dissemination of up-to-date thermodynamic data, primarily for use with the NASA CEA program, but increasingly for use with other computer programs.

  4. Measurements of the PVT properties of water to 25 kbars and 1600°C from synthetic fluid inclusions in corundum

    NASA Astrophysics Data System (ADS)

    Brodholt, John P.; Wood, Bernard J.

    1994-05-01

    We have performed experiments to determine the density of water at pressures and temperatures of 9.5 to 25 kbar and 930 to 1600°C, respectively. The experimental method involved growing inclusions of fluid ( ρ < 1.0 gm/ cm3) in synthetic precracked corundum. Density was determined by measuring the homogenization temperature along the liquid-vapour equilibrium curve. Comparison with the many current equations of state for water indicates that, in the P- V- T range of the experiments, the equations of KERRICK and JACOBS (1981) and BRODHOLT and WOOD (1993) provide the best fits. In contrast the steam tables of HAAR et al. (1984) systematically underestimate the molar volumes at high temperatures.

  5. First principle study of AlX (X=3d, 4d, 5d elements and Lu) dimer.

    PubMed

    Ouyang, Yifang; Wang, Jianchuan; Hou, Yuhua; Zhong, Xiaping; Du, Yong; Feng, Yuanping

    2008-02-21

    The ground state equilibrium bond length, harmonic vibrational frequency, and dissociation energy of AlX (X=3d,4d,5d elements and Lu) dimers are investigated by density functional method B3LYP. The present results are in good agreement with the available experimental and other theoretical values except the dissociation energy of AlCr. The present calculations show that the late transition metal can combine strongly with aluminum compared with the former transition metal. The present calculation also indicates that it is more reasonable to replace La with Lu in the Periodic Table and that the bonding strengths of zinc, cadmium, and mercury with aluminum are very weak.

  6. Growth of early continental crust by partial melting of eclogite.

    PubMed

    Rapp, Robert P; Shimizu, Nobumichi; Norman, Marc D

    2003-10-09

    The tectonic setting in which the first continental crust formed, and the extent to which modern processes of arc magmatism at convergent plate margins were operative on the early Earth, are matters of debate. Geochemical studies have shown that felsic rocks in both Archaean high-grade metamorphic ('grey gneiss') and low-grade granite-greenstone terranes are comprised dominantly of sodium-rich granitoids of the tonalite-trondhjemite-granodiorite (TTG) suite of rocks. Here we present direct experimental evidence showing that partial melting of hydrous basalt in the eclogite facies produces granitoid liquids with major- and trace-element compositions equivalent to Archaean TTG, including the low Nb/Ta and high Zr/Sm ratios of 'average' Archaean TTG, but from a source with initially subchondritic Nb/Ta. In modern environments, basalts with low Nb/Ta form by partial melting of subduction-modified depleted mantle, notably in intraoceanic arc settings in the forearc and back-arc regimes. These observations suggest that TTG magmatism may have taken place beneath granite-greenstone complexes developing along Archaean intraoceanic island arcs by imbricate thrust-stacking and tectonic accretion of a diversity of subduction-related terranes. Partial melting accompanying dehydration of these generally basaltic source materials at the base of thickened, 'arc-like' crust would produce compositionally appropriate TTG granitoids in equilibrium with eclogite residues.

  7. Microscale models of partially molten rocks and their macroscale physical properties

    NASA Astrophysics Data System (ADS)

    Rudge, J. F.

    2017-12-01

    Any geodynamical model of melt transport in the Earth's mantle requires constitutive laws for the rheology of partially molten rock. These constitutive laws are poorly known, and one way to make progress in our understanding is through the upscaling of microscale models which describe physics at the scale of individual mineral grains. Crucially, many upscaled physical properties (such as permeability) depend not only on how much melt is present, but on how that melt is arranged at the microscale; i.e. on the geometry of the melt network. Here I will present some new calculations of equilibrium melt network geometries around idealised tetrakaidecahedral grains. In contrast to several previous calculations of textural equilibrium, these calculations allow for a both a liquid-phase and a solid-phase topology that can tile 3D space. The calculations are based on a simple minimisation of surface energy using the finite element method. In these simple models just two parameters control the topology of the melt network: the porosity (volume fraction of melt), and the dihedral angle. The consquences of these melt geometries for upscaled properties such as permeability; electrical conductivity; and importantly, effective viscosity will be explored. Recent theoretical work [1,2] has suggested that in diffusion creep a small amount of melt may dramatically reduce the effective shear viscosity of a partially molten rock, with profound consequences for the nature of the asthenosphere. This contribution will show that this reduction in viscosity may have been significantly overestimated, so that the drop in the effective viscosity at onset of melting is more modest. [1] Takei, Y., and B. K. Holtzman (2009), Viscous constitutive relations of solid-liquid composites in terms of grain boundary contiguity: 1. Grain boundary diffusion control model, J. Geophys. Res., 114, B06205.[2] Holtzmann B. K. (2016) Questions on the existence, persistence, and mechanical effects of a very small melt fraction in the asthenosphere, Geophys. Geochem. Geosyst. 17, 470-484.

  8. Thermodynamics Behavior of Germanium During Equilibrium Reactions between FeOx-CaO-SiO2-MgO Slag and Molten Copper

    NASA Astrophysics Data System (ADS)

    Shuva, M. A. H.; Rhamdhani, M. A.; Brooks, G. A.; Masood, S.; Reuter, M. A.

    2016-10-01

    The distribution ratio of germanium (Ge), L_{{Ge}}^{s/m} during equilibrium reactions between magnesia-saturated FeOx-CaO-SiO2 (FCS) slag and molten copper has been measured under oxygen partial pressures from 10-10 to 10-7 atm and at temperatures 1473 to 1623 K (1200 to 1350 °C). It was observed that the Ge distribution ratio increases with increasing oxygen partial pressure, and with decreasing temperature. It was also observed that the distribution ratio is strongly dependent on slag basicity. The distribution ratio was observed to increase with increasing optical basicity. At fixed CaO concentration in the slag, the distribution ratio was found to increase with increasing Fe/SiO2 ratio, tending to a plateau at L_{{Ge}}^{s/m} = 0.8. This behavior is consistent with the assessment of ionic bond fraction carried out in this study, and suggested the acidic nature of germanium oxide (GeO2) in the slag system studied. The characterisation results of the quenched slag suggested that Ge is present in the FeOx-CaO-SiO2-MgO slag predominantly as GeO2. At 1573 K (1300 °C) and p_{{{{O}}2 }} = 10-8 atm, the activity coefficient of GeO2 in the slag was calculated to be in the range of 0.24 to 1.50. The results from the current study suggested that less-basic slag, high operating temperature, and low oxygen partial pressure promote a low Ge distribution ratio. These conditions are desired for maximizing Ge recovery, for example, during pyrometallurgical processing of Ge-containing e-waste through secondary copper smelting. Overall, the thermodynamics data generated from this study can be used for process modeling purposes for improving recovery of Ge in primary and secondary copper smelting processes.

  9. Partial migration and transient coexistence of migrants and residents in animal populations.

    PubMed

    Singh, Navinder J; Leonardsson, Kjell

    2014-01-01

    Partial migration, whereby a proportion of the population migrates, is common across the animal kingdom. Much of the focus in the literature has been on trying to explain the underlying mechanisms for the coexistence of migrants and residents. In addition, there has been an increasing number of reports on the prevalence and frequency of partially migratory populations. One possible explanation for the occurrence of partial migration, which has received no attention in the literature, is that of 'transient coexistence' during the invasion phase of a superior behaviour. In this study we develop a theoretical basis for explaining partial migration as a transient coexistence and derive a method to predict the frequency of residents and migrants in partially migrating populations. This method is useful to predict the frequencies of migrants and residents in a small set of populations as a complementing hypothesis to 'an Evolutionary Stable Strategy (ESS)'. We use the logistic growth equation to derive a formula for predicting the frequencies of residents and migrants. We also use simulations and empirical data from white perch (Morone americana), moose (Alces alces) and red deer (Cervus elaphus) to demonstrate our approach. We show that the probability of detecting partial migration due to transient coexistence depends upon a minimum number of tracked or marked individuals for a given number of populations. Our approach provides a starting point in searching for explanations to the observed frequencies, by contrasting the observed pattern with both the predicted transient and the uniform random pattern. Aggregating such information on observed patterns (proportions of migrants and residents) may eventually lead to the development of a quantitative theory for the equilibrium (ESS) populations as well.

  10. Conservative-variable average states for equilibrium gas multi-dimensional fluxes

    NASA Technical Reports Server (NTRS)

    Iannelli, G. S.

    1992-01-01

    Modern split component evaluations of the flux vector Jacobians are thoroughly analyzed for equilibrium-gas average-state determinations. It is shown that all such derivations satisfy a fundamental eigenvalue consistency theorem. A conservative-variable average state is then developed for arbitrary equilibrium-gas equations of state and curvilinear-coordinate fluxes. Original expressions for eigenvalues, sound speed, Mach number, and eigenvectors are then determined for a general average Jacobian, and it is shown that the average eigenvalues, Mach number, and eigenvectors may not coincide with their classical pointwise counterparts. A general equilibrium-gas equation of state is then discussed for conservative-variable computational fluid dynamics (CFD) Euler formulations. The associated derivations lead to unique compatibility relations that constrain the pressure Jacobian derivatives. Thereafter, alternative forms for the pressure variation and average sound speed are developed in terms of two average pressure Jacobian derivatives. Significantly, no additional degree of freedom exists in the determination of these two average partial derivatives of pressure. Therefore, they are simultaneously computed exactly without any auxiliary relation, hence without any geometric solution projection or arbitrary scale factors. Several alternative formulations are then compared and key differences highlighted with emphasis on the determination of the pressure variation and average sound speed. The relevant underlying assumptions are identified, including some subtle approximations that are inherently employed in published average-state procedures. Finally, a representative test case is discussed for which an intrinsically exact average state is determined. This exact state is then compared with the predictions of recent methods, and their inherent approximations are appropriately quantified.

  11. Effects of ground-water chemistry and flow on quality of drainflow in the western San Joaquin Valley, California

    USGS Publications Warehouse

    Fio, John L.; Leighton, David A.

    1994-01-01

    Chemical and geohydrologic data were used to assess the effects of regional ground-water flow on the quality of on-farm drainflows in a part of the western San Joaquin Valley, California. Shallow ground water beneath farm fields has been enriched in stable isotopes and salts by partial evaporation from the shallow water table and is being displaced by irrigation, drainage, and regional ground-water flow. Ground-water flow is primarily downward in the study area but can flow upward in some down- slope areas. Transitional areas exist between the downward and upward flow zones, where ground water can move substantial horizontal distances (0.3 to 3.6 kilometers) and can require 10 to 90 years to reach the downslope drainage systems. Simulation of ground-water flow to drainage systems indicates that regional ground water contributes to about 11 percent of annual drainflow. Selenium concentrations in ground water and drainwater are affected by geologic source materials, partial evaporation from a shallow water table, drainage-system, and regional ground-water flow. Temporal variability in drainflow quality is affected in part by the distribution of chemical constituents in ground water and the flow paths to the drainage systems. The mass flux of selenium in drainflows, or load, generally is proportional to flow, and reductions in drainflow quantity should reduce selenium loads over the short-term. Uncertain changes in the distribution of ground-water quality make future changes in drainflow quality difficult to quantify.

  12. Decompressing recompression chamber attendants during Australian submarine rescue operations.

    PubMed

    Reid, Michael P; Fock, Andrew; Doolette, David J

    2017-09-01

    Inside chamber attendants rescuing survivors from a pressurised, distressed submarine may themselves accumulate a decompression obligation which may exceed the limits of Defense and Civil Institute of Environmental Medicine tables presently used by the Royal Australian Navy. This study assessed the probability of decompression sickness (P DCS ) for medical attendants supervising survivors undergoing oxygen-accelerated saturation decompression according to the National Oceanic and Atmospheric Administration (NOAA) 17.11 table. Estimated probability of decompression sickness (P DCS ), the units pulmonary oxygen toxicity dose (UPTD) and the volume of oxygen required were calculated for attendants breathing air during the NOAA table compared with the introduction of various periods of oxygen breathing. The P DCS in medical attendants breathing air whilst supervising survivors receiving NOAA decompression is up to 4.5%. For the longest predicted profile (830 minutes at 253 kPa) oxygen breathing at 30, 60 and 90 minutes at 132 kPa partial pressure of oxygen reduced the air-breathing-associated P DCS to less than 3.1 %, 2.1% and 1.4% respectively. The probability of at least one incident of DCS among attendants, with consequent strain on resources, is high if attendants breathe air throughout their exposure. The introduction of 90 minutes of oxygen breathing greatly reduces the probability of this interruption to rescue operations.

  13. Raining a magma ocean: Thermodynamics of rocky planets after a giant impact

    NASA Astrophysics Data System (ADS)

    Stewart, S. T.; Lock, S. J.; Caracas, R.

    2017-12-01

    Rocky planets in exoplanetary systems have equilibrium temperatures up to a few 1000 K. The thermal evolution after a giant impact is sensitive to the equilibrium temperature. Post-impact rocky bodies are thermally stratified, with cooler, lower-entropy silicate overlain by vaporized, higher-entropy silicate. The radii of impact-vaporized rocky planets are much larger than the radii of equivalent condensed bodies. Furthermore, after some high-energy, high-angular momentum collisions, the post-impact body exceeds the corotation limit for a rocky planet and forms a synestia. Initially, volatiles and silicates are miscible at the high temperatures of the outer layer. If the equilibrium temperature with the star is lower than the silicate condensation temperature ( 2000 K), silicate droplets form at the photosphere and fall while volatile components remain in the vapor. Radiation and turbulent convection cool the vapor outer layer to the silicate vapor curve. A distinct magma ocean forms as the thermal profile crosses the silicate vapor curve and the critical curves for the volatiles. Near the temperatures and pressures of the critical curves, volatiles and silicates are partially soluble in each other. As the system continues cooling, the volatile vapor and silicate liquid separate toward the end member compositions, which are determined by the equilibrium temperature and the total vapor pressure of volatiles. If the equilibrium temperature with the star is near or above the condensation temperature for silicates, there would be limited condensation at the photosphere. Initially, the cooler lower mantle would slowly, diffusively equilibrate with the hotter upper mantle. In some cases, the thermal profile may cross the silicate vapor curve in the middle of the silicate layer, producing a silicate rain layer within the body. With continued evolution toward an adiabatic thermal profile, the body would separate into a silicate liquid layer underlying a silicate-volatile vapor layer. As the hottest rocky planets become tidally locked to their star, cooling progresses asymmetrically. The timing and degree of differentiation of rocky planets into silicate mantles and volatile atmospheres depends on the thermal evolution of vaporized rocky planets and may vary widely with equilibrium temperature.

  14. Intrinsic dynamics and total energy-shaping control of the ballbot system

    NASA Astrophysics Data System (ADS)

    Satici, A. C.; Donaire, A.; Siciliano, B.

    2017-12-01

    Research on bipedal locomotion has shown that a dynamic walking gait is energetically more efficient than a statically stable one. Analogously, even though statically stable multi-wheeled robots are easier to control, they are energetically less efficient and have low accelerations to avoid tipping over. In contrast, the ballbot is an underactuated, nonholonomically constrained mobile robot, whose upward equilibrium point has to be stabilised by active control. In this work, we derive coordinate-invariant, reduced, Euler-Poincaré equations of motion for the ballbot. By means of partial feedback linearisation, we obtain two independent passive outputs with corresponding storage functions and utilise these to come up with energy-shaping control laws which move the system along the trajectories of a new Lagrangian system whose desired equilibrium point is asymptotically stable by construction. The basin of attraction of this controller is shown to be almost global under certain conditions on the design of the mechanism which are reflected directly in the mass matrix of the unforced equations of motion.

  15. Combustion of hydrogen injected into a supersonic airstream (the SHIP computer program)

    NASA Technical Reports Server (NTRS)

    Markatos, N. C.; Spalding, D. B.; Tatchell, D. G.

    1977-01-01

    The mathematical and physical basis of the SHIP computer program which embodies a finite-difference, implicit numerical procedure for the computation of hydrogen injected into a supersonic airstream at an angle ranging from normal to parallel to the airstream main flow direction is described. The physical hypotheses built into the program include: a two-equation turbulence model, and a chemical equilibrium model for the hydrogen-oxygen reaction. Typical results for equilibrium combustion are presented and exhibit qualitatively plausible behavior. The computer time required for a given case is approximately 1 minute on a CDC 7600 machine. A discussion of the assumption of parabolic flow in the injection region is given which suggests that improvement in calculation in this region could be obtained by use of the partially parabolic procedure of Pratap and Spalding. It is concluded that the technique described herein provides the basis for an efficient and reliable means for predicting the effects of hydrogen injection into supersonic airstreams and of its subsequent combustion.

  16. [Antiplatelet properties of nitrogen monoxide].

    PubMed

    Adrie, C

    1996-11-01

    Nitric (correction of nitrous) oxide (NO) plays a fundamental part in the haemostatic equilibrium between the endothelium and platelets, an equilibrium of established clinical importance in cardiovascular disease. NO stimulates the enzyme guanylate cyclase which is responsible for synthesis of GMPc, the increase of which results in platelet inhibition. Synthesis of NO may have endogenous auto or paracrine origine from platelets or endothelial cells and participates in the local regulation of platelet function in association with other products of endothelial or platelet synthesis. Exogenous administration is common in therapeutics either in molecules which release NO (nitrate derivatives, sodium nitropruside, molsidomine, etc) or by NO gas administered by inhalation. The antiplatelet effect of NO has been clearly demonstrated in vitro, in vivo or ex vivo, in animals and humans, and probably explains, at least partially, the efficacy of nitrate derivatives in ischaemic coronary artery disease. Nevertheless, the platelet inhibition observed with intravenous NO releasing drugs is associated with potentially harmful systemic hypotension. Platelet inhibition by inhalation of NO could be an alternative means of avoiding this unwanted effect.

  17. Study on spatial structure of retailing based on GIS in the city of Wuhan

    NASA Astrophysics Data System (ADS)

    Liu, Cheng-liang; Tian, Ying

    2008-10-01

    With the agility of market economy, the characteristic of market spatial structure becomes more complex since the reformation and open policy. The spatial structure has broken through the traditional framework which is non-equilibriums and scattered, and represented such modern development character as diversification, grade, network, and non-equilibrium. This paper chooses 200 stochastic retailing stores whose acreages all exceed 40m2 in the four circles of Wuhan city, after the analysis of spatial difference on acreages, number, population density, and manage forms with GIS spatial methods, and makes a conclusion that the retailing spatial structure of Wuhan city has took on figure of rating circle wholly and frame of centralization-diffusion and enchasing partially; as location is concerned, centralization and diffusion takes place simultaneously, has behaved that retailing concentrated in heartland of city with more favorable traffic and market location by the means of market infiltration, and distributed in suburb more dispersive by market monopoly.

  18. Silicon Oxysulfide, OSiS: Rotational Spectrum, Quantum-Chemical Calculations, and Equilibrium Structure.

    PubMed

    Thorwirth, Sven; Mück, Leonie Anna; Gauss, Jürgen; Tamassia, Filippo; Lattanzi, Valerio; McCarthy, Michael C

    2011-06-02

    Silicon oxysulfide, OSiS, and seven of its minor isotopic species have been characterized for the first time in the gas phase at high spectral resolution by means of Fourier transform microwave spectroscopy. The equilibrium structure of OSiS has been determined from the experimental data using calculated vibration-rotation interaction constants. The structural parameters (rO-Si = 1.5064 Å and rSi-S = 1.9133 Å) are in very good agreement with values from high-level quantum chemical calculations using coupled-cluster techniques together with sophisticated additivity and extrapolation schemes. The bond distances in OSiS are very short in comparison with those in SiO and SiS. This unexpected finding is explained by the partial charges calculated for OSiS via a natural population analysis. The results suggest that electrostatic effects rather than multiple bonding are the key factors in determining bonding in this triatomic molecule. The data presented provide the spectroscopic information needed for radio astronomical searches for OSiS.

  19. Hysteresis of the Contact Angle of a Meniscus Inside a Capillary with Smooth, Homogeneous Solid Walls.

    PubMed

    Kuchin, Igor V; Starov, Victor M

    2016-05-31

    A theory of contact angle hysteresis of a meniscus inside thin capillaries with smooth, homogeneous solid walls is developed in terms of surface forces (disjoining/conjoining pressure isotherm) using a quasi-equilibrium approach. The disjoining/conjoining pressure isotherm includes electrostatic, intermolecular, and structural components. The values of the static receding θr, advancing θa, and equilibrium θe contact angles in thin capillaries were calculated on the basis of the shape of the disjoining/conjoining pressure isotherm. It was shown that both advancing and receding contact angles depend on the capillary radius. The suggested mechanism of the contact angle hysteresis has a direct experimental confirmation: the process of receding is accompanied by the formation of thick β-films on the capillary walls. The effect of the transition from partial to complete wetting in thin capillaries is predicted and analyzed. This effect takes place in very thin capillaries, when the receding contact angle decreases to zero.

  20. Influence of Molecular Shape on the Thermal Stability and Molecular Orientation of Vapor-Deposited Organic Semiconductors

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Walters, Diane M; Antony, Lucas; de Pablo, Juan

    High thermal stability and anisotropic molecular orientation enhance the performance of vapor-deposited organic semiconductors, but controlling these properties is a challenge in amorphous materials. To understand the influence of molecular shape on these properties, vapor-deposited glasses of three disk-shaped molecules were prepared. For all three systems, enhanced thermal stability is observed for glasses prepared over a wide range of substrate temperatures and anisotropic molecular orientation is observed at lower substrate temperatures. For two of the disk-shaped molecules, atomistic simulations of thin films were also performed and anisotropic molecular orientation was observed at the equilibrium liquid surface. We find that themore » structure and thermal stability of these vapor-deposited glasses results from high surface mobility and partial equilibration toward the structure of the equilibrium liquid surface during the deposition process. For the three molecules studied, molecular shape is a dominant factor in determining the anisotropy of vapor-deposited glasses.« less

  1. De-vitrification of nanoscale phase-separated amorphous thin films in the immiscible copper-niobium system

    NASA Astrophysics Data System (ADS)

    Puthucode, A.; Devaraj, A.; Nag, S.; Bose, S.; Ayyub, P.; Kaufman, M. J.; Banerjee, R.

    2014-05-01

    Copper and niobium are mutually immiscible in the solid state and exhibit a large positive enthalpy of mixing in the liquid state. Using vapour quenching via magnetron co-sputter deposition, far-from equilibrium amorphous Cu-Nb films have been deposited which exhibit a nanoscale phase separation. Annealing these amorphous films at low temperatures (~200 °C) initiates crystallization via the nucleation and growth of primary nanocrystals of a face-centred cubic Cu-rich phase separated by the amorphous matrix. Interestingly, subsequent annealing at a higher temperature (>300 °C) leads to the polymorphic nucleation and growth of large spherulitic grains of a body-centred cubic Nb-rich phase within the retained amorphous matrix of the partially crystallized film. This sequential two-stage crystallization process has been investigated in detail by combining transmission electron microscopy [TEM] (including high-resolution TEM) and atom probe tomography studies. These results provide new insights into the crystallization behaviour of such unusual far-from equilibrium phase-separated metallic glasses in immiscible systems.

  2. A new computational method for reacting hypersonic flows

    NASA Astrophysics Data System (ADS)

    Niculescu, M. L.; Cojocaru, M. G.; Pricop, M. V.; Fadgyas, M. C.; Pepelea, D.; Stoican, M. G.

    2017-07-01

    Hypersonic gas dynamics computations are challenging due to the difficulties to have reliable and robust chemistry models that are usually added to Navier-Stokes equations. From the numerical point of view, it is very difficult to integrate together Navier-Stokes equations and chemistry model equations because these partial differential equations have different specific time scales. For these reasons, almost all known finite volume methods fail shortly to solve this second order partial differential system. Unfortunately, the heating of Earth reentry vehicles such as space shuttles and capsules is very close linked to endothermic chemical reactions. A better prediction of wall heat flux leads to smaller safety coefficient for thermal shield of space reentry vehicle; therefore, the size of thermal shield decreases and the payload increases. For these reasons, the present paper proposes a new computational method based on chemical equilibrium, which gives accurate prediction of hypersonic heating in order to support the Earth reentry capsule design.

  3. Linear spreading speeds from nonlinear resonant interaction

    NASA Astrophysics Data System (ADS)

    Faye, Grégory; Holzer, Matt; Scheel, Arnd

    2017-06-01

    We identify a new mechanism for propagation into unstable states in spatially extended systems, that is based on resonant interaction in the leading edge of invasion fronts. Such resonant invasion speeds can be determined solely based on the complex linear dispersion relation at the unstable equilibrium, but rely on the presence of a nonlinear term that facilitates the resonant coupling. We prove that these resonant speeds give the correct invasion speed in a simple example, we show that fronts with speeds slower than the resonant speed are unstable, and corroborate our speed criterion numerically in a variety of model equations, including a nonlocal scalar neural field model. GF received support from the project NONLOCAL (ANR-14-CE25-0013) funded by the French National Research Agency. MH was partially supported by the National Science Foundation through grant NSF-DMS-1516155. AS was partially supported by the National Science Foundation through grant NSF-DMS-1311740 and through a DAAD Fellowship.

  4. PARTIAL RESTRAINING FORCE INTRODUCTION METHOD FOR DESIGNING CONSTRUCTION COUNTERMESURE ON ΔB METHOD

    NASA Astrophysics Data System (ADS)

    Nishiyama, Taku; Imanishi, Hajime; Chiba, Noriyuki; Ito, Takao

    Landslide or slope failure is a three-dimensional movement phenomenon, thus a three-dimensional treatment makes it easier to understand stability. The ΔB method (simplified three-dimensional slope stability analysis method) is based on the limit equilibrium method and equals to an approximate three-dimensional slope stability analysis that extends two-dimensional cross-section stability analysis results to assess stability. This analysis can be conducted using conventional spreadsheets or two-dimensional slope stability computational software. This paper describes the concept of the partial restraining force in-troduction method for designing construction countermeasures using the distribution of the restraining force found along survey lines, which is based on the distribution of survey line safety factors derived from the above-stated analysis. This paper also presents the transverse distributive method of restraining force used for planning ground stabilizing on the basis of the example analysis.

  5. Variable horizon in a peridynamic medium

    DOE PAGES

    Silling, Stewart A.; Littlewood, David J.; Seleson, Pablo

    2015-12-10

    Here, a notion of material homogeneity is proposed for peridynamic bodies with variable horizon but constant bulk properties. A relation is derived that scales the force state according to the position-dependent horizon while keeping the bulk properties unchanged. Using this scaling relation, if the horizon depends on position, artifacts called ghost forces may arise in a body under a homogeneous deformation. These artifacts depend on the second derivative of the horizon and can be reduced by employing a modified equilibrium equation using a new quantity called the partial stress. Bodies with piecewise constant horizon can be modeled without ghost forcesmore » by using a simpler technique called a splice. As a limiting case of zero horizon, both the partial stress and splice techniques can be used to achieve local-nonlocal coupling. Computational examples, including dynamic fracture in a one-dimensional model with local-nonlocal coupling, illustrate the methods.« less

  6. Electro-physical properties of superconducting ceramic thick film prepared by partial melting method.

    PubMed

    Lee, Sang Heon

    2013-05-01

    BiSrCaCuO superconductor thick films were prepared at several curing temperatures, and their electro-physical properties were determined to find an optimum fabrication conditions. Critical temperatures of the superconductors were decreased with increasing melting temperature, which was related to the amount of equilibrium phases of the superconducting materials with temperature. The critical temperature of BiSrCaCuO bulk and thick film superconductors were 107 K and 96 K, respectively. The variation of susceptibility of the superconductor thick film formed at 950 degrees C had multi-step-type curve for 70 G externally applied field, whereas, a superconductor thick film formed at 885 degrees C had a single step-type curve like a bulk BiSrCaCuO ceramic superconductor in the temperature-susceptibility curves. A partial melting at 865 degrees C is one of optimum conditions for making a superconductor thick film with a relatively homogeneous phase.

  7. Theoretical studies of photoexcitation and ionization in H2O

    NASA Technical Reports Server (NTRS)

    Diercksen, G. H. F.; Kraemer, W. P.; Rescigno, T. N.; Bender, C. F.; Mckoy, B. V.; Langhoff, S. R.; Langhoff, P. W.

    1982-01-01

    Theoretical studies using Franck-Condon and static-exchange approximations are reported for the complete dipole excitation and ionization spectrum in H2O, where (1) large Cartesian Gaussian basis sets are used to represent the required discrete and continuum electronic eigenfunctions at the ground state equilibrium geometry, and (2) previously devised moment-theory techniques are employed in constructing the continuum oscillator-strength densities from the calculated spectra. Comparisons are made of the calculated excitation and ionization profiles with recent experimental photoabsorption studies and corresponding spectral assignments, electron impact-excitation cross sections, and dipole and synchrotron-radiation studies of partial-channel photoionization cross sections. The calculated partial-channel cross sections are found to be atomic-like, and dominated by 2p-kd components. It is suggested that the latter transition couples with the underlying 1b(1)-kb(1) channel, accounting for a prominent feature in recent synchrotron-radiation measurements.

  8. Network connectivity value.

    PubMed

    Dragicevic, Arnaud; Boulanger, Vincent; Bruciamacchie, Max; Chauchard, Sandrine; Dupouey, Jean-Luc; Stenger, Anne

    2017-04-21

    In order to unveil the value of network connectivity, we formalize the construction of ecological networks in forest environments as an optimal control dynamic graph-theoretic problem. The network is based on a set of bioreserves and patches linked by ecological corridors. The node dynamics, built upon the consensus protocol, form a time evolutive Mahalanobis distance weighted by the opportunity costs of timber production. We consider a case of complete graph, where the ecological network is fully connected, and a case of incomplete graph, where the ecological network is partially connected. The results show that the network equilibrium depends on the size of the reception zone, while the network connectivity depends on the environmental compatibility between the ecological areas. Through shadow prices, we find that securing connectivity in partially connected networks is more expensive than in fully connected networks, but should be undertaken when the opportunity costs are significant. Copyright © 2017 Elsevier Ltd. All rights reserved.

  9. Soft particles at a fluid interface

    NASA Astrophysics Data System (ADS)

    Mehrabian, Hadi; Harting, Jens; Snoeijer, Jacco H.

    2015-11-01

    Particles added to a fluid interface can be used as a surface stabilizer in the food, oil and cosmetic industries. As an alternative to rigid particles, it is promising to consider highly deformable particles that can adapt their conformation at the interface. In this study, we compute the shapes of soft elastic particles using molecular dynamics simulations of a cross-linked polymer gel, complemented by continuum calculations based on the linear elasticity. It is shown that the particle shape is not only affected by the Young's modulus of the particle, but also strongly depends on whether the gel is partially or completely wetting the fluid interface. We find that the molecular simulations for the partially wetting case are very accurately described by the continuum theory. By contrast, when the gel is completely wetting the fluid interface the linear theory breaks down and we reveal that molecular details have a strong influence on the equilibrium shape.

  10. Partial molar enthalpies and reaction enthalpies from equilibrium molecular dynamics simulation

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Schnell, Sondre K.; Department of Chemical and Biomolecular Engineering, University of California, Berkeley, California 94720; Department of Chemistry, Faculty of Natural Science and Technology, Norwegian University of Science and Technology, 4791 Trondheim

    2014-10-14

    We present a new molecular simulation technique for determining partial molar enthalpies in mixtures of gases and liquids from single simulations, without relying on particle insertions, deletions, or identity changes. The method can also be applied to systems with chemical reactions. We demonstrate our method for binary mixtures of Weeks-Chandler-Anderson particles by comparing with conventional simulation techniques, as well as for a simple model that mimics a chemical reaction. The method considers small subsystems inside a large reservoir (i.e., the simulation box), and uses the construction of Hill to compute properties in the thermodynamic limit from small-scale fluctuations. Results obtainedmore » with the new method are in excellent agreement with those from previous methods. Especially for modeling chemical reactions, our method can be a valuable tool for determining reaction enthalpies directly from a single MD simulation.« less

  11. Numerical scheme approximating solution and parameters in a beam equation

    NASA Astrophysics Data System (ADS)

    Ferdinand, Robert R.

    2003-12-01

    We present a mathematical model which describes vibration in a metallic beam about its equilibrium position. This model takes the form of a nonlinear second-order (in time) and fourth-order (in space) partial differential equation with boundary and initial conditions. A finite-element Galerkin approximation scheme is used to estimate model solution. Infinite-dimensional model parameters are then estimated numerically using an inverse method procedure which involves the minimization of a least-squares cost functional. Numerical results are presented and future work to be done is discussed.

  12. Approximate Cores of a General Class of Economies. Part II. Set-Up Costs and Firm Formation in Coalition Production Economies,

    DTIC Science & Technology

    1982-02-01

    Figure 5 we depict two simple special cases to illus- trate "Increasing returns to coalition size" where Y[S] depends only on the number of agents in S...for the case where the nuber of types Is greater than one . 29 catch che fundamental nonsymmatry between a firm on existence and a firm- in-being, or...economy is given in terms of individuals, goods, preferences and production sets. Oligopoly theory, partial equilibrium theory and the study of game

  13. Complexity and chaos control in a discrete-time prey-predator model

    NASA Astrophysics Data System (ADS)

    Din, Qamar

    2017-08-01

    We investigate the complex behavior and chaos control in a discrete-time prey-predator model. Taking into account the Leslie-Gower prey-predator model, we propose a discrete-time prey-predator system with predator partially dependent on prey and investigate the boundedness, existence and uniqueness of positive equilibrium and bifurcation analysis of the system by using center manifold theorem and bifurcation theory. Various feedback control strategies are implemented for controlling the bifurcation and chaos in the system. Numerical simulations are provided to illustrate theoretical discussion.

  14. Dynamic adsorption of CO2/N2 on cation-exchanged chabazite SSZ-13: A breakthrough analysis

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Bower, Jamey K.; Barpaga, Dushyant; Prodinger, Sebastian

    2018-04-17

    Alkali exchanged SSZ-13 adsorbents were investigated for their applicability in separating N2 from CO2 in flue gas streams using a dynamic breakthrough method. In contrast to IAST calculations based on equilibrium isotherms, K+ exchanged SSZ-13 was found to yield the best N2 productivity under dynamic conditions where diffusion properties play a significant role. This was attributed to the selective, partial blockage of access to the CHA cavities enhancing the separation potential in a 15/85 CO2/N2 binary gas mixture.

  15. Probing the electrolyte infiltration behaviour of activated carbon supercapacitor electrodes by in situ neutron scattering using aqueous NaCl as electrolyte

    DOE PAGES

    Liu, Yiqun; Li, Chen; Liu, Cong; ...

    2018-04-24

    In situ contrast-matched neutron scattering was used to probe the electrolyte infiltration behavior of activated supercapacitor carbon electrodes using an aquoeus 1 M NaCl solution. It was found that only about 20% of the pore volume was infiltrated at chemical equilibrium. The partial infiltration can be attributed to the co-existence of hydrophilic and hydrophilic pores. As a result, the study suggests that for the achievement of optimal capacitance, supercapacitor electrodes should be evacuated before electrolyte infiltration.

  16. Probing the electrolyte infiltration behaviour of activated carbon supercapacitor electrodes by in situ neutron scattering using aqueous NaCl as electrolyte

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Liu, Yiqun; Li, Chen; Liu, Cong

    In situ contrast-matched neutron scattering was used to probe the electrolyte infiltration behavior of activated supercapacitor carbon electrodes using an aquoeus 1 M NaCl solution. It was found that only about 20% of the pore volume was infiltrated at chemical equilibrium. The partial infiltration can be attributed to the co-existence of hydrophilic and hydrophilic pores. As a result, the study suggests that for the achievement of optimal capacitance, supercapacitor electrodes should be evacuated before electrolyte infiltration.

  17. On CAPM and Black-Scholes differing risk-return strategies

    NASA Astrophysics Data System (ADS)

    McCauley, Joseph L.; Gunaratne, Gemunu H.

    2003-11-01

    In their path-finding 1973 paper, Black and Scholes presented two separate derivations of their famous option pricing partial differential equation. The second derivation was from the standpoint that was Black's original motivation, namely, the capital asset pricing model (CAPM). We show here, in contrast, that the option valuation is not uniquely determined; in particular, strategies based on the delta-hedge and CAPM provide different valuations of an option although both hedges are instantaneouly riskfree. Second, we show explicitly that CAPM is not, as economists claim, an equilibrium theory.

  18. Dynamic Adsorption of CO 2 /N 2 on Cation-Exchanged Chabazite SSZ-13: A Breakthrough Analysis

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Bower, Jamey K.; Barpaga, Dushyant; Prodinger, Sebastian

    2018-03-30

    Alkali exchanged SSZ-13 adsorbents were investigated for their applicability in separating N2 from CO 2 in flue gas streams using a dynamic breakthrough method. In contrast to IAST calculations based on equilibrium isotherms, K+ exchanged SSZ-13 was found to yield the best N2 productivity under dynamic conditions where diffusion properties play a significant role. This was attributed to the selective, partial blockage of access to the CHA cavities enhancing the separation potential in a 15/85 CO2/N2 binary gas mixture.

  19. The method of lines in three dimensional fracture mechanics

    NASA Technical Reports Server (NTRS)

    Gyekenyesi, J.; Berke, L.

    1980-01-01

    A review of recent developments in the calculation of design parameters for fracture mechanics by the method of lines (MOL) is presented. Three dimensional elastic and elasto-plastic formulations are examined and results from previous and current research activities are reported. The application of MOL to the appropriate partial differential equations of equilibrium leads to coupled sets of simultaneous ordinary differential equations. Solutions of these equations are obtained by the Peano-Baker and by the recurrance relations methods. The advantages and limitations of both solution methods from the computational standpoint are summarized.

  20. Ion-atom charge-transfer reactions and a hot intercloud medium. [in interstellar space

    NASA Technical Reports Server (NTRS)

    Steigman, G.

    1975-01-01

    An investigation is conducted concerning the ionization equilibrium of carbon in a hot intercloud medium (ICM), taking into account various charge-transfer reactions. Attention is given to problems related to observations of carbon along the lines of sight to several unreddened stars. It is pointed out that the observed underabundance of C III and overabundance of C I can be consistent with the presence of a hot, partially ionized ICM, provided that two of the charge-transfer reactions considered are rapid at thermal energies.

  1. Studies of Quasar Outflows

    NASA Technical Reports Server (NTRS)

    Arav, Nahum

    2002-01-01

    The main aim of this research program is to determine the ionization equilibrium and abundances in quasar outflows. Especially in the broad absorption line QSO PG 0946+301. We find that the outflow's metalicity is consistent with being solar, while the abundance ratio of phosphorus to other metals is at least ten times solar. These findings are based on diagnostics that are not sensitive to saturation and partial covering effects in the BALs (Broad Adsorption Lines), which considerably weakened previous claims for enhanced metalicity. Ample evidence for these effects is seen in the spectrum.

  2. Lattice Boltzmann model for high-order nonlinear partial differential equations

    NASA Astrophysics Data System (ADS)

    Chai, Zhenhua; He, Nanzhong; Guo, Zhaoli; Shi, Baochang

    2018-01-01

    In this paper, a general lattice Boltzmann (LB) model is proposed for the high-order nonlinear partial differential equation with the form ∂tϕ +∑k=1mαk∂xkΠk(ϕ ) =0 (1 ≤k ≤m ≤6 ), αk are constant coefficients, Πk(ϕ ) are some known differential functions of ϕ . As some special cases of the high-order nonlinear partial differential equation, the classical (m)KdV equation, KdV-Burgers equation, K (n ,n ) -Burgers equation, Kuramoto-Sivashinsky equation, and Kawahara equation can be solved by the present LB model. Compared to the available LB models, the most distinct characteristic of the present model is to introduce some suitable auxiliary moments such that the correct moments of equilibrium distribution function can be achieved. In addition, we also conducted a detailed Chapman-Enskog analysis, and found that the high-order nonlinear partial differential equation can be correctly recovered from the proposed LB model. Finally, a large number of simulations are performed, and it is found that the numerical results agree with the analytical solutions, and usually the present model is also more accurate than the existing LB models [H. Lai and C. Ma, Sci. China Ser. G 52, 1053 (2009), 10.1007/s11433-009-0149-3; H. Lai and C. Ma, Phys. A (Amsterdam) 388, 1405 (2009), 10.1016/j.physa.2009.01.005] for high-order nonlinear partial differential equations.

  3. Lattice Boltzmann model for high-order nonlinear partial differential equations.

    PubMed

    Chai, Zhenhua; He, Nanzhong; Guo, Zhaoli; Shi, Baochang

    2018-01-01

    In this paper, a general lattice Boltzmann (LB) model is proposed for the high-order nonlinear partial differential equation with the form ∂_{t}ϕ+∑_{k=1}^{m}α_{k}∂_{x}^{k}Π_{k}(ϕ)=0 (1≤k≤m≤6), α_{k} are constant coefficients, Π_{k}(ϕ) are some known differential functions of ϕ. As some special cases of the high-order nonlinear partial differential equation, the classical (m)KdV equation, KdV-Burgers equation, K(n,n)-Burgers equation, Kuramoto-Sivashinsky equation, and Kawahara equation can be solved by the present LB model. Compared to the available LB models, the most distinct characteristic of the present model is to introduce some suitable auxiliary moments such that the correct moments of equilibrium distribution function can be achieved. In addition, we also conducted a detailed Chapman-Enskog analysis, and found that the high-order nonlinear partial differential equation can be correctly recovered from the proposed LB model. Finally, a large number of simulations are performed, and it is found that the numerical results agree with the analytical solutions, and usually the present model is also more accurate than the existing LB models [H. Lai and C. Ma, Sci. China Ser. G 52, 1053 (2009)1672-179910.1007/s11433-009-0149-3; H. Lai and C. Ma, Phys. A (Amsterdam) 388, 1405 (2009)PHYADX0378-437110.1016/j.physa.2009.01.005] for high-order nonlinear partial differential equations.

  4. Phase Equilibria in the ZnO-"FeO"-SiO2 System in Reducing Atmosphere and in the ZnO-"FeO"-SiO2-"Cu2O" System in Equilibrium with Liquid Copper Metal at 1250 °C (1523 K)

    NASA Astrophysics Data System (ADS)

    Hidayat, Taufiq; Hayes, Peter C.; Jak, Evgueni

    2018-05-01

    Recent experimental studies in the ZnO-"FeO"-SiO2 system in reducing atmosphere demonstrated significant discrepancies with the current FactSage thermodynamic model developed using previous experimental data in this system in equilibrium with metallic iron and air. The present experimental study on phase equilibria in the ZnO-"FeO"-SiO2-"Cu2O" system in equilibrium with liquid copper at 1250 °C (1523 K) at low copper oxide concentrations in slag was initiated and undertaken to resolve these discrepancies. A high-temperature equilibration-rapid quenching-electron-probe X-ray microanalysis (EPMA) technique using a primary phase substrate support and closed system approach with Cu metal introduced to determine effective equilibrium oxygen partial pressure from the Cumetal/Cu2Oslag equilibria was applied to provide accurate information on the liquidus and corresponding solid compositions in the spinel, willemite, and tridymite primary phase fields. The present results confirmed the accuracy of the FactSage model, resolved discrepancies, and demonstrated significant uncertainties in the recent studies by other authors on the system in the open reducing atmosphere. The present study shows how this closed system approach can be used to obtain key thermodynamic data on phase equilibria in systems containing volatile metal species, overcoming the limitations and uncertainties encountered in conventional open gas/condensed phase equilibration with these systems. The study highlights the importance of the focus on obtaining accurate experimental data and the risks of misleading information from inadequate experimental control and analysis. The study also demonstrates that continuing in-depth critical review and analysis of the elemental reactions taking place in complex systems is an essential step in phase equilibrium research.

  5. Relationships between CO 2, thermodynamic limits on silicate weathering, and the strength of the silicate weathering feedback

    DOE PAGES

    Winnick, Matthew J.; Maher, Kate

    2018-01-27

    Recent studies have suggested that thermodynamic limitations on chemical weathering rates exert a first-order control on riverine solute fluxes and by extension, global chemical weathering rates. As such, these limitations may play a prominent role in the regulation of carbon dioxide levels (pCO 2) over geologic timescales by constraining the maximum global weathering flux. In this study, we develop a theoretical scaling relationship between equilibrium solute concentrations and pCO 2 based on equilibrium constants and reaction stoichiometry relating primary mineral dissolution and secondary mineral precipitation. Here, we test this theoretical scaling relationship against reactive transport simulations of chemical weathering profilesmore » under open-and closed-system conditions, representing partially and fully water-saturated regolith, respectively. Under open-system conditions, equilibrium bicarbonate concentrations vary as a power-law function of pCO 2(y =kx n)where nis dependent on reaction stoichiometry and kis dependent on both reaction stoichiometry and the equilibrium constant. Under closed-system conditions, bicarbonate concentrations vary linearly with pCO 2 at low values and approach open-system scaling at high pCO 2. To describe the potential role of thermodynamic limitations in the global silicate weathering feedback, we develop a new mathematical framework to assess weathering feedback strength in terms of both (1) steady-state atmospheric pCO 2 concentrations, and (2) susceptibility to secular changes in degassing rates and transient carbon cycle perturbations, which we term 1st and 2nd order feedback strength, respectively. Finally, we discuss the implications of these results for the effects of vascular land plant evolution on feedback strength, the potential role of vegetation in controlling modern solute fluxes, and the application of these frameworks to a more complete functional description of the silicate weathering feedback. Most notably, the dependence of equilibrium solute concentrations on pCO 2 may represent a direct weathering feedback largely independent of climate and modulated by belowground organic carbon respiration.« less

  6. Relationships between CO 2, thermodynamic limits on silicate weathering, and the strength of the silicate weathering feedback

    DOE Office of Scientific and Technical Information (OSTI.GOV)

    Winnick, Matthew J.; Maher, Kate

    Recent studies have suggested that thermodynamic limitations on chemical weathering rates exert a first-order control on riverine solute fluxes and by extension, global chemical weathering rates. As such, these limitations may play a prominent role in the regulation of carbon dioxide levels (pCO 2) over geologic timescales by constraining the maximum global weathering flux. In this study, we develop a theoretical scaling relationship between equilibrium solute concentrations and pCO 2 based on equilibrium constants and reaction stoichiometry relating primary mineral dissolution and secondary mineral precipitation. Here, we test this theoretical scaling relationship against reactive transport simulations of chemical weathering profilesmore » under open-and closed-system conditions, representing partially and fully water-saturated regolith, respectively. Under open-system conditions, equilibrium bicarbonate concentrations vary as a power-law function of pCO 2(y =kx n)where nis dependent on reaction stoichiometry and kis dependent on both reaction stoichiometry and the equilibrium constant. Under closed-system conditions, bicarbonate concentrations vary linearly with pCO 2 at low values and approach open-system scaling at high pCO 2. To describe the potential role of thermodynamic limitations in the global silicate weathering feedback, we develop a new mathematical framework to assess weathering feedback strength in terms of both (1) steady-state atmospheric pCO 2 concentrations, and (2) susceptibility to secular changes in degassing rates and transient carbon cycle perturbations, which we term 1st and 2nd order feedback strength, respectively. Finally, we discuss the implications of these results for the effects of vascular land plant evolution on feedback strength, the potential role of vegetation in controlling modern solute fluxes, and the application of these frameworks to a more complete functional description of the silicate weathering feedback. Most notably, the dependence of equilibrium solute concentrations on pCO 2 may represent a direct weathering feedback largely independent of climate and modulated by belowground organic carbon respiration.« less

  7. Relationships between CO2, thermodynamic limits on silicate weathering, and the strength of the silicate weathering feedback

    NASA Astrophysics Data System (ADS)

    Winnick, Matthew J.; Maher, Kate

    2018-03-01

    Recent studies have suggested that thermodynamic limitations on chemical weathering rates exert a first-order control on riverine solute fluxes and by extension, global chemical weathering rates. As such, these limitations may play a prominent role in the regulation of carbon dioxide levels (pCO2) over geologic timescales by constraining the maximum global weathering flux. In this study, we develop a theoretical scaling relationship between equilibrium solute concentrations and pCO2 based on equilibrium constants and reaction stoichiometry relating primary mineral dissolution and secondary mineral precipitation. We test this theoretical scaling relationship against reactive transport simulations of chemical weathering profiles under open- and closed-system conditions, representing partially and fully water-saturated regolith, respectively. Under open-system conditions, equilibrium bicarbonate concentrations vary as a power-law function of pCO2 (y = kxn) where n is dependent on reaction stoichiometry and k is dependent on both reaction stoichiometry and the equilibrium constant. Under closed-system conditions, bicarbonate concentrations vary linearly with pCO2 at low values and approach open-system scaling at high pCO2. To describe the potential role of thermodynamic limitations in the global silicate weathering feedback, we develop a new mathematical framework to assess weathering feedback strength in terms of both (1) steady-state atmospheric pCO2 concentrations, and (2) susceptibility to secular changes in degassing rates and transient carbon cycle perturbations, which we term 1st and 2nd order feedback strength, respectively. Finally, we discuss the implications of these results for the effects of vascular land plant evolution on feedback strength, the potential role of vegetation in controlling modern solute fluxes, and the application of these frameworks to a more complete functional description of the silicate weathering feedback. Most notably, the dependence of equilibrium solute concentrations on pCO2 may represent a direct weathering feedback largely independent of climate and modulated by belowground organic carbon respiration.

  8. Partition functions and equilibrium constants for diatomic molecules and atoms of astrophysical interest

    NASA Astrophysics Data System (ADS)

    Barklem, P. S.; Collet, R.

    2016-04-01

    Partition functions and dissociation equilibrium constants are presented for 291 diatomic molecules for temperatures in the range from near absolute zero to 10 000 K, thus providing data for many diatomic molecules of astrophysical interest at low temperature. The calculations are based on molecular spectroscopic data from the book of Huber & Herzberg (1979, Constants of Diatomic Molecules) with significant improvements from the literature, especially updated data for ground states of many of the most important molecules by Irikura (2007, J. Phys. Chem. Ref. Data, 36, 389). Dissociation energies are collated from compilations of experimental and theoretical values. Partition functions for 284 species of atoms for all elements from H to U are also presented based on data collected at NIST. The calculated data are expected to be useful for modelling a range of low density astrophysical environments, especially star-forming regions, protoplanetary disks, the interstellar medium, and planetary and cool stellar atmospheres. The input data, which will be made available electronically, also provides a possible foundation for future improvement by the community. Full Tables 1-8 are only available at the CDS via anonymous ftp to http://cdsarc.u-strasbg.fr (ftp://130.79.128.5) or via http://cdsarc.u-strasbg.fr/viz-bin/qcat?J/A+A/588/A96

  9. Depth of the vadose zone controls aquifer biogeochemical conditions and extent of anthropogenic nitrogen removal

    USGS Publications Warehouse

    Szymczycha, Beata; Kroeger, Kevin D.; Crusius, John; Bratton, John F.

    2017-01-01

    We investigated biogeochemical conditions and watershed features controlling the extent of nitrate removal through microbial dinitrogen (N2) production within the surficial glacial aquifer located on the north and south shores of Long Island, NY, USA. The extent of N2 production differs within portions of the aquifer, with greatest N2 production observed at the south shore of Long Island where the vadose zone is thinnest, while limited N2production occurred under the thick vadose zones on the north shore. In areas with a shallow water table and thin vadose zone, low oxygen concentrations and sufficient DOC concentrations are conducive to N2production. Results support the hypothesis that in aquifers without a significant supply of sediment-bound reducing potential, vadose zone thickness exerts an important control of the extent of N2 production. Since quantification of excess N2 relies on knowledge of equilibrium N2concentration at recharge, calculated based on temperature at recharge, we further identify several features, such as land use and cover, seasonality of recharge, and climate change that should be considered to refine estimation of recharge temperature, its deviation from mean annual air temperature, and resulting deviation from expected equilibrium gas concentrations.

  10. Saturated-unsaturated flow in a compressible leaky-unconfined aquifer

    NASA Astrophysics Data System (ADS)

    Mishra, Phoolendra K.; Vesselinov, Velimir V.; Kuhlman, Kristopher L.

    2012-06-01

    An analytical solution is developed for three-dimensional flow towards a partially penetrating large-diameter well in an unconfined aquifer bounded below by a leaky aquitard of finite or semi-infinite extent. The analytical solution is derived using Laplace and Hankel transforms, then inverted numerically. Existing solutions for flow in leaky unconfined aquifers neglect the unsaturated zone following an assumption of instantaneous drainage due to Neuman. We extend the theory of leakage in unconfined aquifers by (1) including water flow and storage in the unsaturated zone above the water table, and (2) allowing the finite-diameter pumping well to partially penetrate the aquifer. The investigation of model-predicted results shows that aquitard leakage leads to significant departure from the unconfined solution without leakage. The investigation of dimensionless time-drawdown relationships shows that the aquitard drawdown also depends on unsaturated zone properties and the pumping-well wellbore storage effects.

  11. Radial flow towards well in leaky unconfined aquifer

    NASA Astrophysics Data System (ADS)

    Mishra, P. K.; Kuhlman, K. L.

    2012-12-01

    An analytical solution is developed for three-dimensional flow towards a partially penetrating large- diameter well in an unconfined aquifer bounded below by a leaky aquitard of finite or semi-infinite extent. The analytical solution is derived using Laplace and Hankel transforms, then inverted numerically. Existing solutions for flow in leaky unconfined aquifers neglect the unsaturated zone following an assumption of instantaneous drainage due to Neuman. We extend the theory of leakage in unconfined aquifers by (1) including water flow and storage in the unsaturated zone above the water table, and (2) allowing the finite-diameter pumping well to partially penetrate the aquifer. The investigation of model-predicted results shows that aquitard leakage leads to significant departure from the unconfined solution without leakage. The investigation of dimensionless time-drawdown relationships shows that the aquitard drawdown also depends on unsaturated zone properties and the pumping-well wellbore storage effects.

  12. Spectral irradiance curve calculations for any type of solar eclipse

    NASA Technical Reports Server (NTRS)

    Deepak, A.; Merrill, J. E.

    1974-01-01

    A simple procedure is described for calculating the eclipse function (EF), alpha, and hence the spectral irradiance curve (SIC), (1-alpha), for any type of solar eclipse: namely, the occultation (partial/total) eclipse and the transit (partial/annular) eclipse. The SIC (or the EF) gives the variation of the amount (or the loss) of solar radiation of a given wavelength reaching a distant observer for various positions of the moon across the sun. The scheme is based on the theory of light curves of eclipsing binaries, the results of which are tabulated in Merrill's Tables, and is valid for all wavelengths for which the solar limb-darkening obeys the cosine law: J = sub c (1 - X + X cost gamma). As an example of computing the SIC for an occultation eclipse which may be total, the calculations for the March 7, 1970, eclipse are described in detail.

  13. Pharmacotherapy of focal epilepsy in children: a systematic review of approved agents.

    PubMed

    Arya, Ravindra; Glauser, Tracy A

    2013-04-01

    Partial-onset seizures contribute the bulk of seizure burden in childhood epilepsy. The therapeutic decision making involves consideration of factors specific to drug, patient and socioeconomic situation. This paper systematically reviews the available efficacy/effectiveness evidence for various anti-epileptic drugs (AED) as monotherapy and adjunctive therapy for partial-onset seizures in children. Relevant randomized clinical trials (RCTs) were identified by a structured PubMed search, supplemented by an additional hand search of reference lists and authors' files. Eligible studies were reviewed and data extracted into tables. Included RCTs were classified based on accepted published criteria. Only efficacy and effectiveness outcome measures were evaluated since there is little scientifically rigorous comprehensive AED adverse effects data. Oxcarbazepine is the only AED with Class I evidence for efficacy/effectiveness as initial monotherapy for partial-onset seizures in children. Carbamazepine, clobazam, lamotrigine, phenobarbital, phenytoin, topiramate, valproate, vigabatrin and zonisamide have, at best, Class III efficacy/effectiveness evidence for monotherapy of partial-onset seizures in children. For adjunctive therapy, gabapentin, lamotrigine, levetiracetam, oxcarbazepine and topiramate have Class I efficacy/effectiveness evidence for treatment of pediatric partial-onset seizures. This efficacy/effectiveness analysis must not be used in isolation when selecting therapy. AED selection for a specific child needs to integrate a drug's efficacy/effectiveness data with its safety and tolerability profile, pharmacokinetic properties, available formulations, and patient specific characteristics. It is critical that physicians and patients incorporate all these relevant variables when choosing AED therapy.

  14. Partial least squares correspondence analysis: A framework to simultaneously analyze behavioral and genetic data.

    PubMed

    Beaton, Derek; Dunlop, Joseph; Abdi, Hervé

    2016-12-01

    For nearly a century, detecting the genetic contributions to cognitive and behavioral phenomena has been a core interest for psychological research. Recently, this interest has been reinvigorated by the availability of genotyping technologies (e.g., microarrays) that provide new genetic data, such as single nucleotide polymorphisms (SNPs). These SNPs-which represent pairs of nucleotide letters (e.g., AA, AG, or GG) found at specific positions on human chromosomes-are best considered as categorical variables, but this coding scheme can make difficult the multivariate analysis of their relationships with behavioral measurements, because most multivariate techniques developed for the analysis between sets of variables are designed for quantitative variables. To palliate this problem, we present a generalization of partial least squares-a technique used to extract the information common to 2 different data tables measured on the same observations-called partial least squares correspondence analysis-that is specifically tailored for the analysis of categorical and mixed ("heterogeneous") data types. Here, we formally define and illustrate-in a tutorial format-how partial least squares correspondence analysis extends to various types of data and design problems that are particularly relevant for psychological research that include genetic data. We illustrate partial least squares correspondence analysis with genetic, behavioral, and neuroimaging data from the Alzheimer's Disease Neuroimaging Initiative. R code is available on the Comprehensive R Archive Network and via the authors' websites. (PsycINFO Database Record (c) 2016 APA, all rights reserved).

  15. Condensation and Evaporation of Solar System Materials

    NASA Astrophysics Data System (ADS)

    Davis, A. M.; Richter, F. M.

    2003-12-01

    It is widely believed that the materials making up the solar system were derived from a nebular gas and dust cloud that went through an early high-temperature stage during which virtually all of the material was in the gas phase. At one time, it was thought that the entire inner solar nebula was hot, but it is now believed that most material was processed through regions where high temperatures were achieved. Certainly some material, such as presolar grains (cf., Mendybaev et al., 2002a), has never been exposed to high temperatures. As the system cooled, solids and perhaps liquids began to condense, but at some point the partially condensed materials became isolated from the remaining gas. Various lines of evidence support this view. At the largest scale, there is the observation that the Earth, Moon, Mars, and all chondritic meteorites except for the CI chondrites are depleted to varying degrees in the abundances of moderately volatile elements relative to bulk solar system composition. The CI chondrites reflect the bulk composition of the solar system for all but hydrogen, carbon, nitrogen, oxygen, and the rare gases, the most volatile elements (see Chapter 1.03; Palme et al., 1988; McDonough and Sun, 1995; Humayun and Cassen, 2000). The depletions in moderately volatile elements are, to a significant degree, correlated with condensation temperature, suggesting progressive removal of gas as condensation proceeded ( Cassen, 1996). Additional observations that can be explained by partial condensation are that various particularly primitive components of meteorites (e.g., calcium-, aluminum-rich refractory inclusions, and certain metal grains) have mineralogy and/or details of their chemical composition that are remarkably similar to what is calculated for equilibrium condensates from a solar composition gas. For example, the calcium-, aluminum-rich inclusions (CAIs) in chondritic meteorites have compositions very similar to that calculated for the first 5% of total condensable matter (see Chapter 1.08; Grossman, 1973; Wänke et al., 1974; Grossman and Ganapathy, 1976; Grossman et al., 1977), where CI chondrites are taken to represent total condensable matter.Elemental abundance patterns ordered by volatility certainly could have been produced by partial condensation, but they could also have been caused by partial evaporation. The relative importance of these opposite processes is still subject to debate and uncertainty. It should be remembered that condensation calculations typically assume chemical equilibrium in a closed system, in which case the system has no memory of the path by which it arrived at a given state, and thus the chemical and isotopic composition of the condensed phase cannot be used to distinguish between partial condensation and partial evaporation. Humayun and Clayton (1995) have taken a somewhat different view by arguing that condensation and evaporation are distinguishable, in that evaporation, but not condensation, will produce isotopically fractionated residues. With this idea in mind, they carefully measured the potassium isotopic compositions of a broad range of solar system materials with different degrees of potassium depletion and found them to be indistinguishable. This they took as evidence that evaporation could not have been a significant process in determining the diverse elemental abundance patterns of the various solar system materials they measured, because had evaporation been important in fractionating potassium it would have also fractionated the potassium isotopes. We will qualify this line of reasoning by arguing that evaporation and condensation can under certain conditions produce isotopically fractionated condensed phases (i.e., that partial evaporation can produce isotopically heavy residues and that partial condensation can produce isotopically light condensates) but that under other conditions both can produce elemental fractionations without significant isotopic fractionation. The absence of isotopic fractionation in a volatile element-depleted condensed phase is more a measure of the degree to which the system maintained thermodynamic equilibrium than a diagnostic of whether the path involved condensation or evaporation.The pervasive volatile element depletion of inner solar system planets and the asteroidal parent bodies of most meteorites is a major, but by no means the only reason to consider evaporation and condensation processes in the early history of the solar system. Chondrules appear to have been rapidly heated and then cooled over a period of minutes to hours (see Chapter 1.07). If this occurred in a gas of solar composition under nonequilibrium conditions, chondrules should have partially evaporated and an isotopic fractionation record should remain. The absence of such effects can be used to chonstrain the conditions of chondrule formation (e.g., Alexander et al., 2000; Alexander and Wang, 2001). There is good petrologic, chemical, and isotopic evidence suggesting that certain solar system materials such as the coarse-grained CAIs are likely evaporation residues. For example, the type B CAIs are often found to have correlated enrichments in the heavy isotopes of silicon and magnesium ( Figure 1), and these isotopic fractionations are very much like those of evaporation residues produced in laboratory experiments. Condensation also appears to be a major control of elemental zoning patterns in metal grains in CH chondrites (Meibom et al., 1999, 2001; Campbell et al., 2001; Petaev et al., 2001; Campbell et al., 2002). A more contemporary example is the isotopic and chemical compositions of deep-sea spherules that have been significantly affected by evaporative loss during atmospheric entry ( Davis et al., 1991a; Davis and Brownlee, 1993; Herzog et al., 1994, 1999; Xue et al., 1995; Alexander et al., 2002). (7K)Figure 1. Isotopic mass fractionation effects in CAIs. Most coarse-grained CAIs have enrichments of a few ‰ amu-1 in magnesium and silicon, whereas "fractionation and unknown nuclear" (FUN) CAIs are isotopically heavier. The volatile element depletion patterns of planetary size objects and the chemical and isotopic composition of numerous smaller objects such as chondrules and CAIs provide the motivation to consider evaporation and condensation process in the early solar system. The key point is that the processes that led to chondrules and planets appear to have occurred under conditions very close to equilibrium, whereas the processes that led to CAIs involved significant departures from equilibrium.

  16. A porous flow approach to model thermal non-equilibrium applicable to melt migration

    NASA Astrophysics Data System (ADS)

    Schmeling, Harro; Marquart, Gabriele; Grebe, Michael

    2018-01-01

    We develop an approach for heat exchange between a fluid and a solid phase of a porous medium where the temperatures of the fluid and matrix are not in thermal equilibrium. The formulation considers moving of the fluid within a resting or deforming porous matrix in an Eulerian coordinate system. The approach can be applied, for example, to partially molten systems or to brine transport in porous rocks. We start from an existing theory for heat exchange where the energy conservation equations for the fluid and the solid phases are separated and coupled by a heat exchange term. This term is extended to account for the full history of heat exchange. It depends on the microscopic geometry of the fluid phase. For the case of solid containing hot, fluid-filled channels, we derive an expression based on a time-dependent Fourier approach for periodic half-waves. On the macroscopic scale, the temporal evolution of the heat exchange leads to a convolution integral along the flow path of the solid, which simplifies considerably in case of a resting matrix. The evolution of the temperature in both phases with time is derived by inserting the heat exchange term into the energy equations. We explore the effects of thermal non-equilibrium between fluid and solid by considering simple cases with sudden temperature differences between fluid and solid as initial or boundary conditions, and by varying the fluid velocity with respect to the resting porous solid. Our results agree well with an analytical solution for non-moving fluid and solid. The temperature difference between solid and fluid depends on the Peclet number based on the Darcy velocity. For Peclet numbers larger than 1, the temperature difference after one diffusion time reaches 5 per cent of \\tilde{T} or more (\\tilde{T} is a scaling temperature, e.g. the initial temperature difference). Thus, our results imply that thermal non-equilibrium can play an important role for melt migration through partially molten systems where melt focuses into melt channels near the transition to melt ascent by dykes. Our method is based on solving the convolution integration for the heat exchange over the full flow history, which is numerically expensive. We tested to replace the heat exchange term by an instantaneous, approximate term. We found considerable errors on the short timescale, but a good agreement on the long timescale if appropriate parameters for the approximate terms are used. We derived these parameters which may be implemented in fully dynamical two-phase flow formulations of melt migration in the Earth.

  17. Flight Tests of the Head-Up Display (HUD) in DC-9-20 Ship 382, November 1968 - January 1969. IRAD Line Item Description Number D36-69-033f

    DTIC Science & Technology

    1970-09-14

    in this report was carried out as part of an Independent Research and Development program on the contribution of the Head-Up Display to an All...through windshield. W, by partial mirror, M. and imaged at infinity by lens. L. ] 1 »hMWMMMMMHi^^Hik«ni l TABLE I. ORGANIZATIONAL PRINCIPLES USED...movement of the equipment or its components. Translational movements are unlikely to give trouble because the display format is imaged at infinity

  18. Lightweight Towed Howitzer Demonstrator. Phase 1 and Partial Phase 2. Volume D3. Part 1. Structural Analysis of System.

    DTIC Science & Technology

    1987-04-01

    Volume D3 - Part I Structural Analysis of System DTIC ELECTE a MApril 1987 SE 03 O0 Contract Number DAAA21-86-C-0047 FMC CORPORATION Northern Ordnance... system , In turn. facilitated crew reductilon via hydraulic emplacement, .four-way Joystick tube- lay, and _power ralming. . MC completed C;oncep)t...D3 Structural Analysis of System PART I D3/050 Table of Contents D3/100 Structural Analysis of SystemUD3/110 CXL Memo: October 3, 1986 D3/120 o

  19. University Physics, Study Guide, Revised Edition

    NASA Astrophysics Data System (ADS)

    Benson, Harris

    1996-01-01

    Partial table of contents: Vectors. One-Dimensional Kinematics. Particle Dynamics II. Work and Energy. Linear Momentum. Systems of Particles. Angular Momentum and Statics. Gravitation. Solids and Fluids. Oscillations. Mechanical Waves. Sound. First Law of Thermodynamics. Kinetic Theory. Entropy and the Second Law of Thermodynamics. Electrostatics. The Electric Field. Gauss's Law. Electric Potential. Current and Resistance. The Magnetic Field. Sources of the Magnetic Field. Electromagnetic Induction. Light: Reflection and Refraction. Lenses and Optical Instruments. Wave Optics I. Special Relativity. Early Quantum Theory. Nuclear Physics. Appendices. Answers to Odd-Numbered Exercises and Problems. Index.

  20. Guillian-Barre syndrome as the initial presentation of systemic lupus erythematosus--case report and review of literature.

    PubMed

    Nadri, Quaid; Althaf, Mohammed Mahdi

    2015-01-01

    A number of neurological entities have been associated with systemic lupus erythematosus (SLE). Gullian-Barre syndrome (GBS) as a presenting feature of SLE remains uncommon with just 9 cases reported in the last half-century with the first case reported in 19641-9 (Table 1). We report a young female presenting with GBS in whom SLE and WHO class V lupus nephritis (LN) was subsequently diagnosed. The neurological symptoms partially responded to pulse methylprednisone, intravenous immunoglobulin (IVIG) and plasmapheresis.

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