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Sample records for biomass-coal mixture derived

  1. Mathematical Modelling of the Fixed-Bed Biomass-Coal Co-Gasification Process

    Directory of Open Access Journals (Sweden)

    Donskoy Igor G.

    2016-01-01

    Full Text Available The paper considers mathematical modelling of downdraft fixed-bed gasification process of the mixtures of woody biomass and coal. Biomass/coal ratio, biomass moisture content and air equivalence ratio are varying parameters. Boundaries of the efficient gasification regimes are estimated.

  2. Derived thermodynamic properties of alcohol + cyclohexylamine mixtures

    Directory of Open Access Journals (Sweden)

    IVONA R. RADOVIĆ

    2010-02-01

    Full Text Available Thermal expansion coefficients, α, excess thermal expansion coefficients, αE, isothermal coefficients of pressure excess molar enthalpy, (∂HE/∂pT,x, partial molar volumes, , partial molar volumes at infinite dilution, , partial excess molar volumes, , and partial excess molar volumes at infinite dilution, , were calculated using experimental densities and excess molar volumes, , data. All calculations are performed for the binary systems of cyclohexylamine with 1-propanol or 1-butanol or 2-butanol or 2-methyl-2-propanol. The Redlich–Kister polynomial and the reduced excess molar volume approach were used in the evaluation of these properties. In addition, the aim of this investigation was to provide a set of various volumetric data in order to asses the influence of temperature, chain length and position of hydroxyl group in the alcohol molecule on the molecular interactions in the examined binary mixtures.

  3. Comparison of the energy and environmental performances of nine biomass/coal co-firing pathways.

    Science.gov (United States)

    Kabir, Md Ruhul; Kumar, Amit

    2012-11-01

    Life cycle energy and environmental performances of nine different biomass/coal co-firing pathways to power generation were compared. Agricultural residue (AR), forest residue (FR), and whole trees (WT) as feedstock were analyzed for direct (DC) and parallel co-firing (PC) in various forms (e.g., chip, bale and pellet). Biomass co-firing rate lies in the range of 7.53-20.45% (energy basis; rest of the energy comes from coal) for the co-firing pathways, depending on type of feedstock and densification. Net energy ratios (NER) for FR-, WT-, and AR-based co-firing pathways were 0.39-0.42, 0.39-0.41, and 0.37-0.38, greenhouse gas (GHG) emissions were 957-1004, 967-1014, and 1065-1083 kg CO(2eq)/MWh, acid rain precursor (ARP) emissions were 5.16-5.39, 5.18-5.41, and 5.77-5.93 kgSO(2eq)/MWh, and ground level ozone precursor (GOP) emissions were 1.79-1.89, 1.82-1.93, and 1.88-1.91 kg (NO(x)+VOC)/MWh, respectively. Biomass/coal co-firing life cycle results evaluated in this study are relevant for any jurisdiction around the world. Copyright © 2012 Elsevier Ltd. All rights reserved.

  4. Thermodynamic analyses of a biomass-coal co-gasification power generation system.

    Science.gov (United States)

    Yan, Linbo; Yue, Guangxi; He, Boshu

    2016-04-01

    A novel chemical looping power generation system is presented based on the biomass-coal co-gasification with steam. The effects of different key operation parameters including biomass mass fraction (Rb), steam to carbon mole ratio (Rsc), gasification temperature (Tg) and iron to fuel mole ratio (Rif) on the system performances like energy efficiency (ηe), total energy efficiency (ηte), exergy efficiency (ηex), total exergy efficiency (ηtex) and carbon capture rate (ηcc) are analyzed. A benchmark condition is set, under which ηte, ηtex and ηcc are found to be 39.9%, 37.6% and 96.0%, respectively. Furthermore, detailed energy Sankey diagram and exergy Grassmann diagram are drawn for the entire system operating under the benchmark condition. The energy and exergy efficiencies of the units composing the system are also predicted.

  5. Mixture

    Directory of Open Access Journals (Sweden)

    Silva-Aguilar Martín

    2011-01-01

    Full Text Available Metals are ubiquitous pollutants present as mixtures. In particular, mixture of arsenic-cadmium-lead is among the leading toxic agents detected in the environment. These metals have carcinogenic and cell-transforming potential. In this study, we used a two step cell transformation model, to determine the role of oxidative stress in transformation induced by a mixture of arsenic-cadmium-lead. Oxidative damage and antioxidant response were determined. Metal mixture treatment induces the increase of damage markers and the antioxidant response. Loss of cell viability and increased transforming potential were observed during the promotion phase. This finding correlated significantly with generation of reactive oxygen species. Cotreatment with N-acetyl-cysteine induces effect on the transforming capacity; while a diminution was found in initiation, in promotion phase a total block of the transforming capacity was observed. Our results suggest that oxidative stress generated by metal mixture plays an important role only in promotion phase promoting transforming capacity.

  6. CONFAC Decomposition Approach to Blind Identification of Underdetermined Mixtures Based on Generating Function Derivatives

    NARCIS (Netherlands)

    de Almeida, Andre L. F.; Luciani, Xavier; Stegeman, Alwin; Comon, Pierre

    2012-01-01

    This work proposes a new tensor-based approach to solve the problem of blind identification of underdetermined mixtures of complex-valued sources exploiting the cumulant generating function (CGF) of the observations. We show that a collection of second-order derivatives of the CGF of the observation

  7. Market segment derivation and profiling via a finite mixture model framework

    NARCIS (Netherlands)

    Wedel, M; Desarbo, WS

    2002-01-01

    The Marketing literature has shown how difficult it is to profile market segments derived with finite mixture models. especially using traditional descriptor variables (e.g., demographics). Such profiling is critical for the proper implementation of segmentation strategy. we propose a new finite mix

  8. Derivative spectrophotometric determination of the herbicides picloram and triclopyr in mixtures

    Directory of Open Access Journals (Sweden)

    BILJANA F. ABRAMOVIC

    2007-08-01

    Full Text Available A derivative spectrophotometric method for the determination of the herbicides picloram (4-amino-3,5,6-trichloropicolinic acid and triclopyr (3,5,6-trichloro-2-pyridyloxyacetic acid in mixtures was developed in this work. Derivative spectrophotometric determination of the selected herbicides was preceded by investigations concerning the influence of pH, in the pH interval from 1 to 9. At pH 3.2, picloram and triclopyr solutions are stable under daylight for nine months. This pH was used for all subsequent determinations. It was also found that the use of the first derivative of the spectra at 232 nm was optimal for the determination of picloram, while use of the second derivative of the spectra at 211 nm was best suited for the determination of triclopyr. The calibration curves are linear in the concentration range 0.8 – 13 µg cm-3 with correlation coefficients –0.9998 for picloram and 0.9996 for triclopyr. The limit of detection of the developed method is 0.08 µg cm-3 for picloram and 0.03 µg cm-3 for triclopyr. Derivative spectrophotometry was shown to be an appropriate method for the determination of picloram and triclopyr in mixtures and in pesticide formulations, unlike the deconvolution method.

  9. Formulating blackberry leaf mixtures for preparation of infusions with plant derived sources of sweeteners.

    Science.gov (United States)

    Komes, Draženka; Belščak-Cvitanović, Ana; Ljubičić, Ivan; Durgo, Ksenija; Cindrić, Iva Juranović; Bušić, Arijana; Vojvodić, Aleksandra

    2014-05-15

    Herbal mixtures composed of blackberry leaf and natural sweeteners (dried apples, prunes, figs, raisins, apricots, carrot and sweet potato, stevia leaves and liquorice root) were developed. Their nutritive and bioactive profile, biological activity and sensory properties were determined. Formulated mixtures exhibited lower total polyphenol content (259.09-350.00 mg GAE/L) when compared to plain blackberry leaf, but contained higher content of chlorogenic, ferulic, p-coumaric, rosmarinic acids and quercetin, as well as some macroelements (Ca, K, Mg) and microelements (Ba, Na). Stevia addition to formulated mixtures ensured higher polyphenolic content. Dried carrot exhibited the highest (0.988 g/g) and liquorice the lowest (0.087 g/g) content of total sugars but it contributed to the sweetness with 574.48 mg/L of glycyrrhizic acid derivatives. Plain blackberry leaf extract exhibited cytotoxic and antioxidative activity on human colon cancer cells. Formulated mixtures exhibited improved flavour profile and balanced sweetness in relation to plain blackberry leaf infusion.

  10. Derivation of guidelines for the design of plate evaporators in heat pumps using zeotropic mixtures

    DEFF Research Database (Denmark)

    Elmegaard, Brian; Mancini, Roberta; Zühlsdorf, Benjamin

    2017-01-01

    integration in a spray drying facility. A numerical model of the evaporator is combined with cycle calculations, for estimating the impact of heat transfer area and pressure drop on the coefficient of performance and costs. Common trends are obtained as optimal configurations for the four considered fluids...... minimization of area and pressure drop is found by assessing the relative impact on costs of the heat exchanger area and pressure losses of both working fluid and heat source. The result shows that it is not always convenient to minimize the heat transfer area, since the mixture pressure drop negatively......The present work derives design recommendations for plate heat exchangers used for evaporation of zeotropic mixtures in heat pumps. A parametric study is conducted on the geometry of the heat exchanger, and the analysis is carried out for four working fluids, based on a case study of heat pump...

  11. Alkali-activation potential of biomass-coal co-fired fly ash

    OpenAIRE

    Shearer, C.R.; Provis, J.L.; Bernal, S.A.; Kurtis, K.E.

    2016-01-01

    Co-fired fly ash, derived from the co-combustion of coal and biomass, is examined as a potential precursor for geopolymers. Compared to a coal fly ash, two co-fired fly ashes have a lower vitreous content and higher carbon content, primarily due to differing combustion processing variables. As a result, binders produced with these co-fired fly ashes have reduced reaction potential. Nevertheless, compressive strengths are generally highest for all ashes activated with solutions with a molar ra...

  12. Glove permeation by semiconductor processing mixtures containing glycol-ether derivatives.

    Science.gov (United States)

    Zellers, E T; Ke, H Q; Smigiel, D; Sulewski, R; Patrash, S J; Han, M W; Zhang, G Z

    1992-02-01

    Results of permeation tests of several glove materials challenged with semiconductor processing formulations containing glycolether derivatives are described. Commercial glove samples of nitrile rubber (Edmont), natural rubber (Edmont and Baxter), butyl rubber (North), PVC Baxter), a natural rubber/neoprene/nitrile blend (Pioneer), and a natural rubber/neoprene blend (Playtex) were tested according to the ASTM F739-85 permeation test method (open-loop configuration). The liquid formulations examined included a positive photoresist thinner containing 2-ethoxyethyl acetate (2-EEA), n-butyl acetate, and xylene; a positive photoresist containing 2-EEA, n-butyl acetate, xylene, polymer resins, and photoactive compounds; a negative photoresist containing 2-methoxyethanol (2-ME), xylene, and cyclized poly(isoprene); and pure 2-methoxyethyl acetate (2-MEA), which is the solvent used in a commercial electron-beam resist. With the exception of the negative photoresist, butyl rubber provided the highest level of protection against the solvent mixtures tested, with no breakthrough observed after 4 hr of continuous exposure at 25 degrees C. Nitrile rubber provided the highest level of protection against the negative photoresist and reasonably good protection against initial exposure to the other solvent mixtures. Gloves consisting of natural rubber or natural rubber blends provided less protection against the mixtures than either nitrile or butyl rubber. For most of the glove samples, permeation of the glycol-ether derivatives contained in the mixtures was faster than that predicted from the permeation of the pure solvents. Increasing the exposure temperature from 25 to 37 degrees C did not significantly affect the performance of the butyl rubber glove. For the other gloves, however, exposures at 37 degrees C resulted in decreases in breakthrough times of 25-75% and increases in steady-state permeation rates of 80-457% relative to values obtained at 25 degrees C. Repeated

  13. An assessment of the information content of likelihood ratios derived from complex mixtures.

    Science.gov (United States)

    Marsden, Clare D; Rudin, Norah; Inman, Keith; Lohmueller, Kirk E

    2016-05-01

    With the increasing sensitivity of DNA typing methodologies, as well as increasing awareness by law enforcement of the perceived capabilities of DNA typing, complex mixtures consisting of DNA from two or more contributors are increasingly being encountered. However, insufficient research has been conducted to characterize the ability to distinguish a true contributor (TC) from a known non-contributor (KNC) in these complex samples, and under what specific conditions. In order to investigate this question, sets of six 15-locus Caucasian genotype profiles were simulated and used to create mixtures containing 2-5 contributors. Likelihood ratios were computed for various situations, including varying numbers of contributors and unknowns in the evidence profile, as well as comparisons of the evidence profile to TCs and KNCs. This work was intended to illustrate the best-case scenario, in which all alleles from the TC were detected in the simulated evidence samples. Therefore the possibility of drop-out was not modeled in this study. The computer program DNAMIX was then used to compute LRs comparing the evidence profile to TCs and KNCs. This resulted in 140,000 LRs for each of the two scenarios. These complex mixture simulations show that, even when all alleles are detected (i.e. no drop-out), TCs can generate LRs less than 1 across a 15-locus profile. However, this outcome was rare, 7 of 140,000 replicates (0.005%), and associated only with mixtures comprising 5 contributors in which the numerator hypothesis includes one or more unknown contributors. For KNCs, LRs were found to be greater than 1 in a small number of replicates (75 of 140,000 replicates, or 0.05%). These replicates were limited to 4 and 5 person mixtures with 1 or more unknowns in the numerator. Only 5 of these 75 replicates (0.004%) yielded an LR greater than 1,000. Thus, overall, these results imply that the weight of evidence that can be derived from complex mixtures containing up to 5 contributors

  14. Derivative-ratio spectrophotometric method for the determination of ternary mixture of aspirin, paracetamol and salicylic acid

    Science.gov (United States)

    El-Yazbi, Fawzi A.; Hammud, Hassan H.; Assi, Sulaf A.

    2007-10-01

    A derivative spectrophotometric method was developed for the assay of a ternary mixture of aspirin (ASP), paracetamol (PAR) and salicylic acid (SAL). The method is based on the use of the first and second derivatives of the ratio spectra and measurement at zero-crossing wavelengths. The ratio spectra were obtained by dividing the absorption spectrum of the mixture by that of one of the components. The concentration of the other components are then determined from their respective calibration curves treated similarly. The described method was applied for the determination of these combinations in synthetic mixtures and dosage forms. The results obtained were accurate and precise.

  15. Determination of neodymium in rare earth mixtures by fourth-derivative spectrophotometry

    Energy Technology Data Exchange (ETDEWEB)

    Naixing Wang; Weian Liang (Shandong Univ., Jinan, SD (China)); Ping Qi (Shandong Analysis and Test Center, Jinan (China))

    1991-11-20

    The absorption spectra corresponding to 4f electron transitions of the neodymium complex with xylenol orange and cetylpyridinium chloride in the presence of Triton X-100 are reported. The absorption by neo-dymium is increased by factor 666, compared with that of its chloride. Fourth-derivative spectra are used to increase the sensitivity and to eliminate interferences from other rare elements. Beer's law is obeyed for 1.4-7.2 {mu}g Nd in 25 ml of solution. Relative standard deviation is 0.8% for 5.0 {mu}g/25 ml (n=7). Detection limits are 5.0 ng ml{sup -1} for Nd alone and 11.0 ng ml{sup -1} in the presence of 45 ng of lanthanum. Satisfactory results were obtained for the determination of neodymium in rare earth mixtures. (author). 11 refs.; 4 figs.

  16. Decomposition driven interface evolution for layers of binary mixtures: I. Model derivation and stratified base states

    CERN Document Server

    Thiele, Uwe; Frastia, Lubor

    2007-01-01

    A dynamical model is proposed to describe the coupled decomposition and profile evolution of a free surface film of a binary mixture. An example is a thin film of a polymer blend on a solid substrate undergoing simultaneous phase separation and dewetting. The model is based on model-H describing the coupled transport of the mass of one component (convective Cahn-Hilliard equation) and momentum (Navier-Stokes-Korteweg equations) supplemented by appropriate boundary conditions at the solid substrate and the free surface. General transport equations are derived using phenomenological non-equilibrium thermodynamics for a general non-isothermal setting taking into account Soret and Dufour effects and interfacial viscosity for the internal diffuse interface between the two components. Focusing on an isothermal setting the resulting model is compared to literature results and its base states corresponding to homogeneous or vertically stratified flat layers are analysed.

  17. Optical properties of aerosol mixtures derived from sun-sky radiometry during SAMUM-2

    Energy Technology Data Exchange (ETDEWEB)

    Toledano, C. (Meteorological Institute, Ludwig-Maximilians-Universitaet, Munich (Germany); Group of Atmospheric Optics, Valladolid Univ., Valladolid (Spain)), e-mail: toledano@goa.uva.es; Wiegner, M.; Gross, S. (Meteorological Institute, Ludwig-Maximilians-Universitaet, Munich (Germany)) (and others)

    2011-09-15

    The SAMUM-2 experiment took place in the Cape Verde islands in January-February 2008. The colocated ground-based and airborne instruments allow the study of desert dust optical and microphysical properties in a closure experiment. The Meteorological Institute of the Univ. of Munich deployed one sun-sky photometer and two tropospheric lidar systems. A travelling AERONET-Cimel sun-sky radiometer was also deployed. During the measurement period the aerosol scenario over Cape Verde mostly consisted of a dust layer below 2 km and a smoke-dust layer above 2-4 km a.s.l. The Saharan dust arrived at the site from the NE, whereas the smoke originated in the African equatorial region. This paper describes the main results of the Sun photometer observations, supported by lidar information. An analysis of the variations in the aerosol optical depth (AOD) in the range 340-1550 nm, the Aangstroem exponent, volume size distributions and single scattering albedo is presented. The aerosol mixtures are analysed by means of the fine mode fraction of the AOD provided by the sun-sky inversion data and the Spectral Deconvolution Algorithm. The mean AOD (500 nm) was 0.31, with associated low Aangstroem exponent of 0.46. Several types of events were detected within the data set, with prevalence of dust or mixtures as characterized by the Aangstroem exponents of extinction and absorption and the fine mode fraction. Aerosol properties derived from sunphotometry were compared to in situ measurements of size distribution, effective radius and single scattering albedo

  18. Derivative spectrophotometric method for simultaneous determination of zofenopril and fluvastatin in mixtures and pharmaceutical dosage forms.

    Science.gov (United States)

    Stolarczyk, Mariusz; Maślanka, Anna; Apola, Anna; Rybak, Wojciech; Krzek, Jan

    2015-09-05

    Fast, accurate and precise method for the determination of zofenopril and fluvastatin was developed using spectrophotometry of the first (D1), second (D2), and third (D3) order derivatives in two-component mixtures and in pharmaceutical preparations. It was shown, that the developed method allows for the determination of the tested components in a direct manner, despite the apparent interference of the absorption spectra in the UV range. For quantitative determinations, "zero-crossing" method was chosen, appropriate wavelengths for zofenopril were: D1 λ=270.85 nm, D2 λ=286.38 nm, D3 λ=253.90 nm. Fluvastatin was determined at wavelengths: D1 λ=339.03 nm, D2 λ=252.57 nm, D3 λ=258.50 nm, respectively. The method was characterized by high sensitivity and accuracy, for zofenopril LOD was in the range of 0.19-0.87 μg mL(-1), for fluvastatin 0.51-1.18 μg mL(-1), depending on the class of derivative, and for zofenopril and fluvastatin LOQ was 0.57-2.64 μg mL(-1) and 1.56-3.57 μg mL(-1), respectively. The recovery of individual components was within the range of 100±5%. For zofenopril, the linearity range was estimated between 7.65 μg mL(-1) and 22.94 μg mL(-1), and for fluvastatin between 5.60 μg mL(-1) and 28.00 μg mL(-1).

  19. Derivative spectrophotometric method for simultaneous determination of zofenopril and fluvastatin in mixtures and pharmaceutical dosage forms

    Science.gov (United States)

    Stolarczyk, Mariusz; Maślanka, Anna; Apola, Anna; Rybak, Wojciech; Krzek, Jan

    2015-09-01

    Fast, accurate and precise method for the determination of zofenopril and fluvastatin was developed using spectrophotometry of the first (D1), second (D2), and third (D3) order derivatives in two-component mixtures and in pharmaceutical preparations. It was shown, that the developed method allows for the determination of the tested components in a direct manner, despite the apparent interference of the absorption spectra in the UV range. For quantitative determinations, "zero-crossing" method was chosen, appropriate wavelengths for zofenopril were: D1 λ = 270.85 nm, D2 λ = 286.38 nm, D3 λ = 253.90 nm. Fluvastatin was determined at wavelengths: D1 λ = 339.03 nm, D2 λ = 252.57 nm, D3 λ = 258.50 nm, respectively. The method was characterized by high sensitivity and accuracy, for zofenopril LOD was in the range of 0.19-0.87 μg mL-1, for fluvastatin 0.51-1.18 μg mL-1, depending on the class of derivative, and for zofenopril and fluvastatin LOQ was 0.57-2.64 μg mL-1 and 1.56-3.57 μg mL-1, respectively. The recovery of individual components was within the range of 100 ± 5%. For zofenopril, the linearity range was estimated between 7.65 μg mL-1 and 22.94 μg mL-1, and for fluvastatin between 5.60 μg mL-1 and 28.00 μg mL-1.

  20. Gasification of coal-derived chars in synthesis gas mixtures under intraparticle mass-transfer-controlled conditions

    NARCIS (Netherlands)

    Bliek, A.; Lont, J.C.; van Swaaij, Willibrordus Petrus Maria

    1986-01-01

    A model has been formulated to describe the quasi-steady-state gasification of coal-derived chars in gas mixtures where both the reactants carbon dioxide and steam, and the gasification products carbon monoxide and hydrogen are present. As such, these conditions reflect the situation found in most

  1. Calorimetry is not color-blind.Molecular insights on association processes in surfactant-polymer mixtures derived from calorimetric experiments

    Institute of Scientific and Technical Information of China (English)

    LOH Watson; BRINATTI Cesar

    2012-01-01

    This comment will review and discuss recent results obtained with the use of calorimetry in assessing molecular information from complex phenomena such as association in surfactant/polymer mixtures.These examples were selected to support the view that it is possible to ally the great sensitivity of modern calorimeters with carefully planned experiments and,sometimes,ancillary techniques in order to derive detailed information on molecular interactions.

  2. Lanolin-derived lipid mixtures mimic closely the lipid composition and organization of vernix caseosa lipids.

    Science.gov (United States)

    Rissmann, Robert; Oudshoorn, Marion H M; Kocks, Elise; Hennink, Wim E; Ponec, Maria; Bouwstra, Joke A

    2008-10-01

    The aim of the present study was to use semi-synthetic lipid mixtures to mimic the complex lipid composition, organization and thermotropic behaviour of vernix caseosa (VC) lipids. As VC shows multiple protecting and barrier supporting properties before and after birth, it is suggested that a VC substitute could be an innovative barrier cream for barrier deficient skin. Lanolin was selected as the source of the branched chain sterol esters and wax esters--the main lipid classes of VC. Different lipid fractions were isolated from lanolin and subsequently mixed with squalene, triglycerides, cholesterol, ceramides and fatty acids to generate semi-synthetic lipid mixtures that mimic the lipid composition of VC, as established by high-performance thin-layer chromatography. Differential scanning calorimetry and Fourier transform infrared spectroscopy investigations revealed that triglycerides play an important role in the (lateral) lipid organization and thermotropic behaviour of the synthetic lipid mixtures. Excellent resemblance of VC lipids was obtained when adding unsaturated triglycerides. Moreover, these lipid mixtures showed similar long range ordering as VC. The optimal lipid mixture was evaluated on tape-stripped hairless mouse skin in vivo. The rate of barrier recovery was increased and comparable to VC lipid treatment.

  3. Aggregation Properties of an Amphiphilic Methanofullerene Derivative in THF-H2O Solvent Mixtures

    Institute of Scientific and Technical Information of China (English)

    Guan Wu WANG; Li Juan JIAO; Er Hong HAO; Yong Ming LU; You Jun YANG

    2004-01-01

    Amphiphilic methanofullerene 1 exhibits strong tendency to form aggregates in THF-H2O solvent mixtures. Two different aggregation processes induced by either varying the solvent composition or upon standing have been found. Concentration has great influence on the aggregation process. Paralleling to the UV-Vis changes, an unusual solvatochromism has been observed in these two different processes.

  4. Characterization of the bioactive and mechanical behavior of dental ceramic/sol-gel derived bioactive glass mixtures.

    Science.gov (United States)

    Abbasi, Zahra; Bahrololoum, Mohammad E; Bagheri, Rafat; Shariat, Mohammad H

    2016-02-01

    Dental ceramics can be modified by bioactive glasses in order to develop apatite layer on their surface. One of the benefits of such modification is to prolong the lifetime of the fixed dental prosthesis by preventing the formation of secondary caries. Dental ceramic/sol-gel derived bioactive glass mixture is one of the options for this modification. In the current study, mixtures of dental ceramic/bioactive glass with different compositions were successfully produced. To evaluate their bioactive behavior, prepared samples were immersed in a simulated body fluid at various time intervals. The prepared and soaked specimens were characterized using Fourier transform infrared spectroscopy, X-ray diffractometry and scanning electron microscopy. Since bioactive glasses have deleterious effects on the mechanical properties of dental ceramics, 3-point bending tests were used to evaluate the flexural strength, flexural strain, tangent modulus of elasticity and Weibull modulus of the specimens in order to find the optimal relationship between mechanical and bioactive properties.

  5. ZIF-78 membrane derived from amorphous precursors with permselectivity for cyclohexanone/cyclohexanol mixture

    KAUST Repository

    Fan, Lili

    2014-07-01

    Cyclohexanone and cyclohexanol are products of selective oxidation of cyclohexane. They are important industrial intermediates and difficult to be separated due to their close boiling points. In this work, well-intergrown ZIF-78 membrane was successfully synthesized on the porous silica substrate by secondary growth method and applied for separation of cyclohexanone/cyclohexanol mixture for the first time. Meanwhile, a facile method for seeding procedure was developed by utilizing the amorphous ZIF-78 precursors to provide better-distributed nucleation sites. Both XRD and SEM results confirmed the good quality of the membrane. The pervaporation separation of cyclohexanone/ cyclohexanol mixture were carried out at room temperature with permselectivity of 1:2 and total flux around 8.7 × 10-2 kg m-2 h-1. © 2013 Elsevier Inc. All rights reserved.

  6. Application of derivative, derivative ratio, and multivariate spectral analysis and thin-layer chomatography-densitometry for determination of a ternary mixture containing drotaverine hydrochloride, caffeine, and paracetamol.

    Science.gov (United States)

    Metwally, Fadia H; El-Saharty, Yasser S; Refaat, Mohamed; El-Khateeb, Sonia Z

    2007-01-01

    New selective, precise, and accurate methods are described for the determination of a ternary mixture containing drotaverine hydrochloride (I), caffeine (II), and paracetamol (III). The first method uses the first (D1) and third (D3) derivative spectrophotometry at 331 and 315 nm for the determination of (I) and (III), respectively, without interference from (II). The second method depends on the simultaneous use of the first derivative of the ratio spectra (DD1) with measurement at 312.4 nm for determination of (I) using the spectrum of 40 microg/mL (III) as a divisor or measurement at 286.4 and 304 nm after using the spectrum of 4 microg/mL (I) as a divisor for the determination of (II) and (III), respectively. In the third method, the predictive abilities of the classical least-squares, principal component regression, and partial least-squares were examined for the simultaneous determination of the ternary mixture. The last method depends on thin-layer chromatography-densitometry after separation of the mixture on silica gel plates using ethyl acetate-chloroform-methanol (16 + 3 + 1, v/v/v) as the mobile phase. The spots were scanned at 281, 272, and 248 nm for the determination of (I), (II), and (III), respectively. Regression analysis showed good correlation in the selected ranges with excellent percentage recoveries. The chemical variables affecting the analytical performance of the methodology were studied and optimized. The methods showed no significant interferences from excipients. Intraday and interday assay precision and accuracy values were within regulatory limits. The suggested procedures were checked using laboratory-prepared mixtures and were successfully applied for the analysis of their pharmaceutical preparations. The validity of the proposed methods was further assessed by applying a standard addition technique. The results obtained by applying the proposed methods were statistically analyzed and compared with those obtained by the manufacturer

  7. Development and Validation of First Order Derivative Spectrophotometric method for simultaneous estimation of Nifedipine and Metoprolol Succinate in Synthetic Mixture

    Directory of Open Access Journals (Sweden)

    Sojitra Rajanit

    2015-02-01

    Full Text Available The present manuscript describe simple, sensitive, rapid, accurate, precise and economical first derivative spectrophotometric method for the simultaneous determination of Nifedipine (NIFand Metoprolol Succinate (METin synthetic mixture. The derivative spectrophotometric method was based on the determination of both the drugs at their respective zero crossing point (ZCP. The first order derivative spectra was obtained in methanol and the determinations were made at 283.80 nm (ZCP of nifedipine for metoprolol succinate and 242.60 nm (ZCP of metoprolol succinate for nifedipine. The linearity was obtained in the concentration range of succinate 5-25 μg/ml for nifedipine and 25-125μg/ml for metoprolol. The mean recovery was 99.64 and 99.41 for Nifedipine and Metoprolol succinate, respectively. The method was found to be simple, sensitive, accurate and precise and was applicable for the simultaneous determination of Nifedipine and Metoprolol succinate in synthetic mixture. The results of analysis have been validated statistically and by recovery studies.

  8. A comparative study of different aspects of manipulating ratio spectra applied for ternary mixtures: derivative spectrophotometry versus wavelet transform.

    Science.gov (United States)

    Salem, Hesham; Lotfy, Hayam M; Hassan, Nagiba Y; El-Zeiny, Mohamed B; Saleh, Sarah S

    2015-01-25

    This work represents a comparative study of different aspects of manipulating ratio spectra, which are: double divisor ratio spectra derivative (DR-DD), area under curve of derivative ratio (DR-AUC) and its novel approach, namely area under the curve correction method (AUCCM) applied for overlapped spectra; successive derivative of ratio spectra (SDR) and continuous wavelet transform (CWT) methods. The proposed methods represent different aspects of manipulating ratio spectra of the ternary mixture of Ofloxacin (OFX), Prednisolone acetate (PA) and Tetryzoline HCl (TZH) combined in eye drops in the presence of benzalkonium chloride as a preservative. The proposed methods were checked using laboratory-prepared mixtures and were successfully applied for the analysis of pharmaceutical formulation containing the cited drugs. The proposed methods were validated according to the ICH guidelines. A comparative study was conducted between those methods regarding simplicity, limitation and sensitivity. The obtained results were statistically compared with those obtained from the reported HPLC method, showing no significant difference with respect to accuracy and precision.

  9. Combustion of biomass-derived, low caloric value, fuel gas in a gasturbine combustor

    Energy Technology Data Exchange (ETDEWEB)

    Andries, J.; Hoppesteyn, P.D.J.; Hein, K.R.G. [Technische Univ. Delf (Netherlands)

    1998-09-01

    The use of biomass and biomass/coal mixtures to produce electricity and heat reduces the net emissions of CO{sub 2}, contributes to the restructuring of the agricultural sector, helps to reduce the waste problem and saves finite fossil fuel reserves. Pressurised fluidised bed gasification followed by an adequate gas cleaning system, a gas turbine and a steam turbine, is a potential attractive way to convert biomass and biomass/coal mixtures. To develop and validate mathematical models, which can be used to design and operate Biomass-fired Integrated Gasification Combined Cycle (BIGCC) systems, a Process Development Unit (PPDU) with a maximum thermal capacity of 1.5 MW{sub th}, located at the Laboratory for Thermal Power Engineering of the Delft University of Technology in The Netherlands is being used. The combustor forms an integral part of this facility. Recirculated flue gas is used to cool the wall of the combustor. (orig.)

  10. Reactivity of Imidazole Derivatives toward Phosphate Triester in DMSO/Water Mixtures: A Comprehensive Study on the Solvent Effect.

    Science.gov (United States)

    Campos, Renan B; Santos, Everton H; Oliveira, Alfredo R M; Ocampos, Fernanda Maria Marins; Souza, Bruno S; Barison, Andersson; Orth, Elisa S

    2015-08-07

    Many imidazole (IMZ) derivatives of pharmaceutical interest, which are potentially catalytic in dephosphorylation reactions, are soluble solely in mixtures of water and organic solvent. In order to understand these poorly explored reactions and properly compare them, a thorough study related to solvent effects for the analogous spontaneous reaction and with common IMZ derivatives is necessary, which is lacking in the literature. Herein, we report a quantitative solvent effect analysis in DMSO/water mixtures for (i) the hydrolysis reaction of diethyl 2,4-dinitrophenylphosphate (DEDNPP) and (ii) the nucleophilic reaction of IMZ and 1-methylimidazole (MEI) with DEDNPP. The solvent effect was fitted satisfactorily with multiple regression analysis, correlating the obtained second-order rate constants with solvent parameters such as acidity, basicity, and polarity/polarizability from Catalán's scale. The contribution of these parameters can be taken into account to elucidate the reactivity in these media. Interestingly, IMZ is more reactive than MEI in DMSO, compared to water alone, which is attributed to the availability of hydrogen-bond formation. Nuclear magnetic resonance spectroscopy ((1)H, (13)C, and (31)P), mass spectrometry, thermodynamic analysis, and density functional theory calculations were carried out to corroborate the proposed nucleophilic mechanism.

  11. Characterization of fine and carbonaceous particles emissions from pelletized biomass-coal blends combustion: Implications on residential crop residue utilization in China

    Science.gov (United States)

    Xu, Yue; Wang, Yan; Chen, Yingjun; Tian, Chongguo; Feng, Yanli; Li, Jun; Zhang, Gan

    2016-09-01

    Bulk biofuel, biomass pellets and pelletized biomass-coal blends were combusted in a typical rural conventional household stove and a high-efficiency stove. Reductions in PM2.5, organic carbon (OC) and elemental carbon (EC) emissions were evaluated by comparing emission factors (EFs) among 19 combinations of biofuel/residential stove types measured using a dilution sampling system. In the low-efficiency stove, the average EFs of PM2.5, OC, and EC of biomass pellets were 2.64 ± 1.56, 0.42 ± 0.36, and 0.30 ± 0.11 g/kg, respectively, significantly lower than those burned in bulk form. EFPM2.5 and EFOC of pelletized biomass combustion in the high-efficiency stove were lower than those of the same biofuel burned in the low-efficiency stove. Furthermore, pelletized corn residue and coal blends burned in the high-efficiency stove could significantly decrease emissions. Compared with the bulk material burned in the low-efficiency stove, the reduction rates of PM2.5, OC and EC from pelletized blends in the high-efficiency stove can reach 84%, 96% and 93%, respectively. If the annually produced corn residues in 2010 had been blended with 10% anthracite coal powder and burnt as pellets, it would have reduced about 82% of PM2.5, 90-96% of OC and 81-92% of EC emission in comparison with burning raw materials in conventional household stoves. Given the low cost, high health benefit and reduction effect on atmospheric pollutants, pelletized blends could be a promising alternative to fossil fuel resources or traditional bulk biofuel.

  12. Non-ideal behavior of binary aqueous mixtures of some urea derivatives and their capacity to induce lysozyme gelation.

    Science.gov (United States)

    de Souza, Ícaro F T; Arêas, Elizabeth P G

    2017-07-29

    The urea derivatives, namely, ethylurea (EU), 1,3 dimethylurea (1,3-DMU) and 1,1 diethylurea (1,1-DEU), in the limiting regions of their solubilities in water, and tetramethylurea (TMU) at w≥0.65 were investigated in relation to their capacity of inducing hen egg white lysozyme (HEWL) physical (non-covalent) gelation. Protein transparent gels were generated out of TMU/H2O and 1,1-DEU/H2O, respectively, whereas an intensively turbid gel resulted from sol-gel transition taking place in EU/H2O. Oscillatory rheology revealed distinctions in the gels' structural and dynamic characteristics. Hydration patterns of the derivatives in solution, sizes of their non-polar domains and supramolecular symmetry features played a central role in their capacity of gel formation and in the gels' rheological behavior and morphology. Effects on gel characteristics of distinctively positioned ions in the Hofmeister series showed that SCN(-) disrupted water H-bonding interconnectivity in TMU lysozyme gel, strengthening gel structure, yet maintaining gel transparency. Citrate enhanced system elasticity albeit causing intense turbidity and leading to phase separation. Larger values of the storage modulus, G', were verified for gels generated from binary mixtures containing urea derivatives with higher dipole moments. Copyright © 2017 Elsevier Inc. All rights reserved.

  13. Deriving binary phase diagrams for chromonic materials in water mixtures via fluorescence spectroscopy: cromolyn and water.

    Science.gov (United States)

    Van Hecke, Gerald R; Karukstis, Kerry K; Rayermann, Scott

    2015-01-14

    We report here the first example of a new and novel method of determining the binary temperature-composition phase diagram of a chromonic material in water using its intrinsic fluorescence. Disodium cromoglycate, or cromolyn, is an anti-allergy medicine representative of a class of compounds known as the chromonics. We have discovered that cromolyn's fluorescence is very sensitive to the polarity, hence structure, of the phase it exhibits. The fluorescence signal shifts its wavelength maximum and its shape depending on whether the cromolyn is a single phase or in coexisting phases. Since the signal due to individual phases can be identified, the fluorescence signal can reveal the temperature-induced transitions between single phase and phase coexistence regions. By studying such fluorescence data for different compositions, an isobaric temperature-composition phase diagram may be constructed. We present here a phase diagram derived from fluorescence studies that is in agreement with previous determinations using other techniques. Our results suggest that the binary phase diagrams of other intrinsically fluorescent chromonic materials, such as perylene monoimide and bisimide derivatives used in organic optoelectronic devices, solar cells, and light-emitting diodes, can be studied in water using an analogous fluorescence approach.

  14. Model studies on the pattern of volatiles generated in mixtures of amino acids, lipid-oxidation-derived aldehydes, and glucose.

    Science.gov (United States)

    Adams, An; Kitryté, Vaida; Venskutonis, Rimantas; De Kimpe, Norbert

    2011-02-23

    The development of flavor and browning in thermally treated foods results mainly from the Maillard reaction and lipid degradation but also from the interactions between both reaction pathways. To study these interactions, we analyzed the volatile compounds resulting from model reactions of lysine or glycine with aldehydes originating from lipid oxidation [hexanal, (E)-2-hexenal, or (2E,4E)-decadienal] in the presence and absence of glucose. The main reaction products identified in these model mixtures were carbonyl compounds, resulting essentially from amino-acid-catalyzed aldol condensation reactions. Several 2-alkylfurans were detected as well. Only a few azaheterocyclic compounds were identified, in particular 5-butyl-2-propylpyridine from (E)-2-hexenal model systems and 2-pentylpyridine from (2E,4E)-decadienal model reactions. Although few reaction products were found resulting from the condensation of an amino acid with a lipid-derived aldehyde, the amino acid plays an important role in catalyzing the degradation and further reaction of these carbonyl compounds. These results suggest that amino-acid-induced degradations and further reactions of lipid oxidation products may be of considerable importance in thermally processed foods.

  15. Variational principles for linear and nonlinear mixtures: New derivations and application to bilinear materials and yield behavior

    Science.gov (United States)

    Alqaraleh, Sahar Mubarak

    2006-04-01

    We study in this paper the effective energy potential of nonlinear composites in terms of the corresponding energy potential for linear material. We study this for power law material using Suquet's variational principle, for bilinear material using Ponte Castaneda variational principle, and we studied the yield behavior as limiting cases of both. We show that three established variational principles can be derived from the Cauchy-Buniakowski-Schwartz inequality; these variational principles (bounds) are: (a) bounds on yield behavior of mixtures, (b) The Hashin-Shtrikman variational principle for linear materials, (c) The Debotton and Ponte Castaneda bound for power-law polycrystals. We also compute the actual stress and strain fields for laminate material for two choices of the average strain, and compute a bound on the effective potential for spherical inclusions using Hashin's linear bound, as well as for spheroidal inclusions using Willis's linear bound. We obtained bounds sharper than the established bounds for both laminate and aligned ellipsoids geometry, and we investigate also how the bound depends on the specified geometry and on specific parameters of the problem.

  16. Analytical methods for the determination of mixtures of bisphenols and derivatives in human and environmental exposure sources and biological fluids. A review

    Energy Technology Data Exchange (ETDEWEB)

    Caballero-Casero, N.; Lunar, L.; Rubio, S., E-mail: qa1rubrs@uco.es

    2016-02-18

    Bisphenol A (BPA) is ubiquitous in humans and the environment. Its potential adverse effects through genomic and non-genomic pathways have fostered BPA replacement by bisphenol analogs that, unfortunately, exert similar adverse effects. Many of these analogs, as well as their derivatives, have already found in humans and the environment and major concerns have arisen over their low dose- and mixture-related effects. This review aims to discuss the characteristics of the main analytical methods reported so far for the determination of mixtures of bisphenol analogs and/or derivatives in human and environmental exposure sources and biological fluids. Approaches followed for removal of background contamination, sample preparation and separation and detection of mixtures of bisphenols and derivatives are critically discussed. Sample treatment is matrix-dependent and common steps include analyte isolation, removal of interferences, evaporation of the extracts and solvent reconstitution. Separation and quantification has been almost exclusively carried out by liquid chromatography tandem mass spectrometry (LC-MS/MS) or gas chromatography mass spectrometry (GC–MS), in the last case prior derivatization, but LC-fluorescence detection has also found some applications. Main characteristics, advantages and drawbacks of these methods will be comparatively discussed. Although at an early stage, some approaches for the assessment of the risk to mixtures of bisphenols, mainly based on the combination of chemical target analysis and toxicity evaluation, have been already applied and they will be here presented. Current knowledge gaps hindering a reliable assessment of human and environmental risk to mixtures of bisphenols and derivatives will be outlined. - Highlights: • Analytical methods for the (bio)monitoring of mixtures of bisphenols are reviewed. • LC and CG coupled to MS are the preferred techniques. • Method-dependent sample treatments are required to remove matrix

  17. Synthesis and antibacterial activity of sulfonamide derivatives at C-8 alkyl chain of anacardic acid mixture isolated from a natural product cashew nut shell liquid (CNSL)

    Indian Academy of Sciences (India)

    N Subhakara Reddy; A Srinivas Rao; M Adharvana Chari; V Ravi Kumar; V Jyothy; V Himabindu

    2012-05-01

    Synthesis and antibacterial activity of some novel biologically active sulfonamide derivatives at C-8 alkyl chain of anacardic acid (7a-7l), prepared from commercially available anacardic acid mixture (1a-d). These compounds were tested for Gram positive and Gram negative bacterial cultures; most of the compounds showed higher antibacterial activity compared with standard drug ampicillin.

  18. Continuous Wavelet Transform, a powerful alternative to Derivative Spectrophotometry in analysis of binary and ternary mixtures: A comparative study.

    Science.gov (United States)

    Elzanfaly, Eman S; Hassan, Said A; Salem, Maissa Y; El-Zeany, Badr A

    2015-12-05

    A comparative study was established between two signal processing techniques showing the theoretical algorithm for each method and making a comparison between them to indicate the advantages and limitations. The methods under study are Numerical Differentiation (ND) and Continuous Wavelet Transform (CWT). These methods were studied as spectrophotometric resolution tools for simultaneous analysis of binary and ternary mixtures. To present the comparison, the two methods were applied for the resolution of Bisoprolol (BIS) and Hydrochlorothiazide (HCT) in their binary mixture and for the analysis of Amlodipine (AML), Aliskiren (ALI) and Hydrochlorothiazide (HCT) as an example for ternary mixtures. By comparing the results in laboratory prepared mixtures, it was proven that CWT technique is more efficient and advantageous in analysis of mixtures with severe overlapped spectra than ND. The CWT was applied for quantitative determination of the drugs in their pharmaceutical formulations and validated according to the ICH guidelines where accuracy, precision, repeatability and robustness were found to be within the acceptable limit.

  19. A mixture of peptides and sugars derived from plant cell walls increases plant defense responses to stress and attenuates ageing-associated molecular changes in cultured skin cells.

    Science.gov (United States)

    Apone, Fabio; Tito, Annalisa; Carola, Antonietta; Arciello, Stefania; Tortora, Assunta; Filippini, Lucio; Monoli, Irene; Cucchiara, Mirna; Gibertoni, Simone; Chrispeels, Maarten J; Colucci, Gabriella

    2010-02-15

    Small peptides and aminoacid derivatives have been extensively studied for their effect of inducing plant defense responses, and thus increasing plant tolerance to a wide range of abiotic stresses. Similarly to plants, these compounds can activate different signaling pathways in mammalian skin cells as well, leading to the up-regulation of anti-aging specific genes. This suggests the existence of analogous defense response mechanisms, well conserved both in plants and animal cells. In this article, we describe the preparation of a new mixture of peptides and sugars derived from the chemical and enzymatic digestion of plant cell wall glycoproteins. We investigate the multiple roles of this product as potential "biostimulator" to protect plants from abiotic stresses, and also as potential cosmeceutical. In particular, the molecular effects of the peptide/sugar mixture of inducing plant defense responsive genes and protecting cultured skin cells from oxidative burst damages were deeply evaluated.

  20. Formation of nitric oxide, ethyl nitrite and an oxathiolone derivative of caffeic acid in a mixture of saliva and white wine.

    Science.gov (United States)

    Takahama, Umeo; Tanaka, Mariko; Hirota, Sachiko

    2010-03-01

    Reactions of salivary nitrite with components of wine were studied using an acidic mixture of saliva and wine. The formation of nitric oxide (NO) in the stomach after drinking wine was observed. The formation of NO was also observed in the mixture (pH 3.6) of saliva and wine, which was prepared by washing the oral cavity with wine. A part of the NO formation in the stomach and the oral cavity was due to the reduction of salivary nitrite by caffeic and ferulic acids present in wine. Ethyl nitrite produced by the reaction of salivary nitrite and ethyl alcohol in wine also contributed to the formation of NO. In addition to the above reactions, caffeic acid in wine could be transformed to the oxathiolone derivative, which might have pharmacological functions. The results obtained in this study may help in understanding the effects of drinking wine on human health.

  1. Curing Kinetics and Thermal Stability of Diglycidyl Ether of Bisphenol-A Using Mixtures of Heterocyclic Derivatives of Stannanes and 4,4'-Diaminodiphenylsulfone

    Institute of Scientific and Technical Information of China (English)

    SINGH Vikram; DEEP Gagan; NARULA Anudeep Kumar

    2008-01-01

    Curing kinetics of diglycidyl ether of bisphenol-A (DGEBA) in the presence of varying molar ratios of derivafives of stannanes to 4,4'-diaminodiphenylsulfone (DDS) was investigated by the dynamic differential scanning calorimetry. The derivatives were synthesized by reacting 1 mole of biguanide (B) with 1 mole of phenylethyltindihydride (PETH) or phenylmethyltindihydride (PMTH) or phenylbutyltindihydride (PBTH) and designated as BPETH or BPMTH or BPBTH respectively. These derivatives were characterized by elemental analysis and spectroscopic techniques such as IR, 1H NMR, 13C NMR and 119Sn NMR. The mixtures of these derivatives to DDS at of epoxy resins. The thermal stability of the isothermally cured resins was also evaluated using dynamic thermogravimetry in a nitrogen atmosphere.

  2. Hydrolysis of solubilized hemicellulose derived from wet-oxidized wheat straw by a mixture of commercial fungal enzyme preparations

    Energy Technology Data Exchange (ETDEWEB)

    Skammelsen Schmidt, Anette; Thomsen, Alle Belinda; Woidemann, Anders [Risoe National Lab. (Denmark); Tenkanen, Maija [VTT Biotechnology and Food Research (Finland)

    1998-04-01

    The enzymatic hydrolysis of the solubilized hemicellulose fraction from wet-oxidized wheat straw was investigated for quantification purposes. An optimal hydrolysis depends on factors such as composition of the applied enzyme mixture and the hydrolysis conditions (enzyme loading, hydrolysis time, pH-value, and temperature). A concentrated enzyme mixture was used in this study prepared at VTT Biotechnology and Food Research, Finland, by mixing four commercial enzyme preparations. No distinctive pH-value and temperature optima were identified after a prolonged incubation of 24 hours. By reducing the hydrolysis time to 2 hours a temperature optimum was found at 50 deg. C, where a pH-value higher than 5.2 resulted in reduced activity. An enzyme-substrate-volume-ratio of 0.042, a pH-value of 5.0, and a temperature of 50 deg. C were chosen as the best hydrolysis conditions due to an improved monosaccharide yield. The hydrolysis time was chosen to be 24 hours to ensure equilibrium and total quantification. Even under the best hydrolysis conditions, the overall sugar yield from the enzymatic hydrolysis was only 85% of that of the optimal acid hydrolysis. The glucose yield were approximately the same for the two types of hydrolyses, probably due to the high cellulase activity in the VTT-enzyme mixture. For xylose and arabinose the enzymatic hydrolysis yielded only 80% of that of the acid hydrolysis. As the pentoses existed mainly as complex polymers their degradation required many different enzymes, some of which might be missing from the VTT-enzyme mixture. Furthermore, the removal of side-choins from the xylan backbone during the wet-oxidation pretreatment process might enable the hemicellulosic polymers to interact and precipitate, hence, reducing the enzymatic digestibility of the hemicellulose. (au) 8 tabs., 10 ills., 65 refs.

  3. Structure-retention and mobile phase-retention relationships for reversed-phase high-performance liquid chromatography of several hydroxythioxanthone derivatives in binary acetonitrile-water mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Amiri, Ali Asghar; Hemmateenejad, Bahram; Safavi, Afsaneh; Sharghi, Hashem; Beni, Ali Reza Salimi [Department of Chemistry, Shiraz University, Shiraz (Iran, Islamic Republic of); Shamsipur, Mojtaba [Department of Chemistry, Razi University, Kermanshah (Iran, Islamic Republic of)], E-mail: mshamsipur@yahoo.com

    2007-12-12

    The reversed-phase high-performance liquid chromatographic (RP-HPLC) behavior of some newly synthesized hydroxythioxanthone derivatives using binary acetonitrile-water mixtures as mobile phase has been examined. First, the variation in the retention time of each molecule as a function of mobile phase properties was studied by Kamlet-Taft solvatochromic equations. Then, the influences of molecular structure of the hydroxythioxanthone derivatives on their retention time in various mobile phase mixtures were investigated by quantitative structure-property relationship (QSPR) analysis. Finally, a unified model containing both the molecular structure parameters and mobile phase properties was developed to describe the chromatographic behavior of the systems studied. Among the solvent properties, polarity/polarizability parameter ({pi}{sup *}) and hydrogen-bond basicity ({beta}), and among the solute properties, the most positive local charge (MPC), the sum of positive charges on hydrogen atoms contributing in hydrogen bonding (SPCH) and lipophilicity index (log P) were identified as controlling factors in the RP-HPLC behavior of hydroxythioxanthone derivatives in actonitrile-water binary solvents.

  4. Structure-retention and mobile phase-retention relationships for reversed-phase high-performance liquid chromatography of several hydroxythioxanthone derivatives in binary acetonitrile-water mixtures.

    Science.gov (United States)

    Amiri, Ali Asghar; Hemmateenejad, Bahram; Safavi, Afsaneh; Sharghi, Hashem; Beni, Ali Reza Salimi; Shamsipur, Mojtaba

    2007-12-12

    The reversed-phase high-performance liquid chromatographic (RP-HPLC) behavior of some newly synthesized hydroxythioxanthone derivatives using binary acetonitrile-water mixtures as mobile phase has been examined. First, the variation in the retention time of each molecule as a function of mobile phase properties was studied by Kamlet-Taft solvatochromic equations. Then, the influences of molecular structure of the hydroxythioxanthone derivatives on their retention time in various mobile phase mixtures were investigated by quantitative structure-property relationship (QSPR) analysis. Finally, a unified model containing both the molecular structure parameters and mobile phase properties was developed to describe the chromatographic behavior of the systems studied. Among the solvent properties, polarity/polarizability parameter (pi*) and hydrogen-bond basicity (beta), and among the solute properties, the most positive local charge (MPC), the sum of positive charges on hydrogen atoms contributing in hydrogen bonding (SPCH) and lipophilicity index (logP) were identified as controlling factors in the RP-HPLC behavior of hydroxythioxanthone derivatives in actonitrile-water binary solvents.

  5. Simultaneous spectrophotometric determination of overlapping spectra of paracetamol and caffeine in laboratory prepared mixtures and pharmaceutical preparations using continuous wavelet and derivative transform

    Directory of Open Access Journals (Sweden)

    Ahmed Ashour

    2015-03-01

    Full Text Available In the present paper, two spectrophotometric methods were used for the simultaneous analysis of paracetamol (PCT and caffeine (CAF in their laboratory prepared mixtures and pharmaceutical preparations. Simple spectrophotometric analysis of PCT and CAF is not possible due to their complete spectral overlap. The proposed methods are based on the application of continuous wavelet transform (CWT and derivative transform (using Savitsky–Golay filters on the ratio spectra to predict each of CAF and PCT. Several wavelet families were tested. Coif1 and Sym2 were found to give best results under optimum conditions. The transformed signals of ratio spectra were used to plot the calibration curves for both components. The predictability of the built calibrations was validated through their application on several synthetic mixtures of both drugs. The proposed methods were used for the prediction of CAF and PCT in pharmaceutical preparation. The obtained results were statistically compared to a reference HPLC method. No significant differences were found between the obtained results and those from the reference method. Being simple, rapid, cheap and sensitive, the proposed methods are recommended for the routine daily analysis of these two drugs in their mixtures in quality control laboratories.

  6. Synthesis of single-walled carbon nanotubes by the pyrolysis of a compression activated iron(II) phthalocyanine/phthalocyanine metal-free derivative/ferric acetate mixture

    Indian Academy of Sciences (India)

    Tawanda Mugadza; Edith Antunes; Tebello Nyokong

    2015-07-01

    This paper reports on the synthesis of single walled carbon nanotubes (SWCNTs) from an activated mixture of iron (II) phthalocyanine, its metal-free derivative and ferric acetate. The powdered mixture was activated by compression into a tablet by applying a force of 300 kN, followed by re-grinding into powder and heating it to high temperatures (1000°C). The activation by compression resulted in more than 50% debundling of SWCNTs as judged by transition electron microscopy. Acid functionalization of the SWCNTs was confirmed by the increase in the D:G ratio from 0.56 to 0.87 in the Raman spectra and the observation of an average of one carboxylic acid group per 13 carbon atoms from thermogravimetric analysis (TGA). TGA also showed that the initial decomposition temperatures for the activated and non-activated mixtures to be 205°C and 245°C, respectively. Hence, activation leads to the lowering of the pyrolysis temperature of the phthalocyanines. X-ray diffraction, electronic absorption and Fourier transform infrared spectra were also employed to characterize the SWCNT.

  7. Effects of mixtures of persistent organic pollutants (POPs) derived from cod liver oil on H295R steroidogenesis.

    Science.gov (United States)

    Montaño, M; Zimmer, K E; Dahl, E; Berg, V; Olsaker, I; Skaare, J U; Murk, A J; Ropstad, E; Verhaegen, S

    2011-09-01

    Crude cod liver oil and liver oil supplements are consumed as a source of vitamin A, D and polyunsaturated fatty acids; during winter and early pregnancy. Crude cod liver oil however constitutes a considerable source of persistent organic pollutants (POPs). This paper aimed at characterizing and quantifying the influence of POP mixtures extracted from three different steps in the cod liver oil industrial process on hormone production and the expression of steroidogenesis-related genes in H295R cells. Exposure to extracts from crude cod liver oil and from its industrial waste increased progesterone (P4), cortisol (Cort), testosterone (T) and estradiol (E2) production; and among others, the expression of MC2R, CYP11B1 and HSD3B2 genes. Observed effects after exposure to pharmaceutical cod liver oil extract were considerably lower. The type of effects on gene expression and hormone production were similar to those induced by forskolin and PCBs, the latter being the major contaminants within the extracts. Additional research is required to further unveil the mechanisms behind the observed steroidogenic effects and to assess whether the potential risk might outweigh the potential benefits of crude and processed cod liver oil consumption. Copyright © 2011 Elsevier Ltd. All rights reserved.

  8. Mapping wildfire susceptibility in Southern California using live and dead fractions of vegetation derived from Multiple Endmember Spectral Mixture Analysis of MODIS imagery

    Science.gov (United States)

    Schneider, P.; Roberts, D. A.

    2008-12-01

    Wildfire is a significant natural disturbance mechanism in Southern California. Assessing spatial patterns of wildfire susceptibility requires estimates of the live and dead fractions of vegetation. The Fire Potential Index (FPI), which is currently the only operationally computed fire susceptibility index incorporating remote sensing data, estimates such fractions using a relative greenness measure based on time series of vegetation index images. This contribution assesses the potential of Multiple Endmember Spectral Mixture Analysis (MESMA) for deriving such fractions from single MODIS images without the need for a long remote sensing time series, and investigates the applicability of such MESMA-derived fractions for mapping dynamic fire susceptibility in Southern California. Endmembers for MESMA were selected from a library of reference endmembers using Constrained Reference Endmember Selection (CRES), which uses field estimates of fractions to guide the selection process. Fraction images of green vegetation, non-photosynthetic vegetation, soil, and shade were then computed for all available 16-day MODIS composites between 2000 and 2006 using MESMA. Initial results indicate that MESMA of MODIS imagery is capable of providing reliable estimates of live and dead vegetation fraction. Validation against in situ observations in the Santa Ynez Mountains near Santa Barbara, California, shows that the average fraction error for two tested species was around 10%. Further validation of MODIS-derived fractions was performed against fractions from high-resolution hyperspectral data. It was shown that the fractions derived from data of both sensors correlate with R2 values greater than 0.95. MESMA-derived live and dead vegetation fractions were subsequently tested as a substitute to relative greenness in the FPI algorithm. FPI was computed for every day between 2000 and 2006 using the derived fractions. Model performance was then tested by extracting FPI values for

  9. Mixture Experiments

    Energy Technology Data Exchange (ETDEWEB)

    Piepel, Gregory F.

    2007-12-01

    A mixture experiment involves combining two or more components in various proportions or amounts and then measuring one or more responses for the resulting end products. Other factors that affect the response(s), such as process variables and/or the total amount of the mixture, may also be studied in the experiment. A mixture experiment design specifies the combinations of mixture components and other experimental factors (if any) to be studied and the response variable(s) to be measured. Mixture experiment data analyses are then used to achieve the desired goals, which may include (i) understanding the effects of components and other factors on the response(s), (ii) identifying components and other factors with significant and nonsignificant effects on the response(s), (iii) developing models for predicting the response(s) as functions of the mixture components and any other factors, and (iv) developing end-products with desired values and uncertainties of the response(s). Given a mixture experiment problem, a practitioner must consider the possible approaches for designing the experiment and analyzing the data, and then select the approach best suited to the problem. Eight possible approaches include 1) component proportions, 2) mathematically independent variables, 3) slack variable, 4) mixture amount, 5) component amounts, 6) mixture process variable, 7) mixture of mixtures, and 8) multi-factor mixture. The article provides an overview of the mixture experiment designs, models, and data analyses for these approaches.

  10. AP/二茂铁衍生物混合体系的热感度研究%Study on thermal sensitivity of AP and ferrocene derivative mixtures

    Institute of Scientific and Technical Information of China (English)

    王宁; 赵孝彬; 罗岚; 李彦荣; 段卫毅

    2011-01-01

    通过局部热感度试验和DSC-TG联用仪,研究了高氯酸铵(AP)和一种二茂铁衍生物(EMT)混合体系的热感度.结果表明,减小AP粒度或增加EMT含量,能缩小AP高低温分解峰之间的差距,提高AP低温分解量,混合物的局部热感度增加.AP存在下,EMT的侧链容易发生断裂,断裂后的二茂铁或二茂铁离子活性体对AP分解起催化作用.此外,EMT 不利于AP的质子转移过程,但对HClO4的分解有较强催化作用.%Thermal sensitivity of AP and ferrocene derivative (EMT) mixtures was studied by partial thermal sensitivity and DSC-TG coupling. The results indicate that reducing AP particle size or increasing the content of EMT can shorten the gap between high-temperature thermal decomposition peak of AP and low-temperature thermal decomposition peak of AP, enhance the low-temperature thermad decomposition amount of AP,and increase partial thermal sensitivity about mixtures of AP and EMT. In the presence of AP, side-chain of EMT is easily ruptured. Residual main skeleton, ferrocene or ferrocene ion, is the real catalyst to thermal decomposition of AP. Furthermore, EMT inhabits proton transfer process of AP, but it is a strong catalysis of EMT to decomposition of HCIO4, one of initial decomposition product of AP.

  11. Reversed-phase high performance liquid chromatography (RP-HPLC) characteristics of some 9,10-anthraquinone derivatives using binary acetonitrile-water mixtures as mobile phase.

    Science.gov (United States)

    Hemmateenejad, B; Shamsipur, M; Safavi, A; Sharghi, H; Amiri, A A

    2008-10-19

    The retention behavior of 28 synthesized 9,10-anthraquinone derivatives in a reversed-phase (RP) high performance liquid chromatography (HPLC) system has been studied on a C18-RP column using acetonitrile-water mixtures as mobile phase. The influences of the composition of mobile phase and the solute structure on the retention times of 9,10-anthraquinone derivatives were investigated by linear solvation free energy relationship (LSFER) and quantitative structure-retention relationship (QSRR) analyses. Among different solvatochromic parameters of solvent systems, their polarity/polarizability parameter (pi*) was identified as the controlling factor affecting retention behavior of these compounds. A four-parametric QSRR model was obtained between solute structures and retention indices. Finally, a unified model containing both the molecular structure parameters and mobile phase properties was developed to describe the chromatographic behavior of the systems studied. The resulted QSRR models could explain and predict higher than 90% of variances in the retention indices. Among the solvent properties, polarity/polarizability parameter (pi*), and among the solute properties, HATS5v (leverage-weighted autocorrelation of lag 5/weighted by atomic van der Waals volumes, GETAWAY descriptors), Mor14p (3D-MoRSE-signal 14/weighted by atomic polarizabilities, 3D-MoRSE descriptors), GATS5p (Geary autocorrelation-lag 5/weighted by atomic polarizabilities, 2D autocorrelations) and R6u+(R maximal autocorrelation of lag 6/unweighted, GETAWAY descriptors) were identified as controlling factors in the RP-HPLC behavior of 9,10-anthraquinone derivatives in actonitrile-water binary solvents.

  12. The Spectrophotometric Multicomponent Analysis of a Ternary Mixture of Ibuprofen, Caffeine and Paracetamol by the Combination of Double Divisor-Ratio Spectra Derivative and H-Point Standard Addition Method

    Directory of Open Access Journals (Sweden)

    R. Hajian

    2012-01-01

    Full Text Available A new spectrophotometric method was developed for the simultaneous analysis of a ternary mixture containing paracetamol (PAR, ibuprofen (IBU and caffeine (CAF without prior separation. H-point standard addition method (HPSAM was used for the first time in the analysis of a component (IBU in a ternary mixture (paracetamol, ibuprofen and caffeine. In contrast, PAR and CAF determined using double divisor ratio spectra derivative method. This method is based on the use of derivative of the ratio spectrum obtained by dividing the absorption spectrum of the ternary mixture by a standard spectrum of a mixture of two of the three compounds in the title mixture. The concentrations of PAR and CAF compounds in their mixture are determined by using their respective standard addition graphs which are obtained by measuring the amplitude at either the maximum or minimum wavelengths selected. The mathematical explanation of the procedure is illustrated. It was shown that at wavelengths 226 and 260 nm, the coordinate of H-point is only dependent on the concentration of IBU without any interference by PAR and CAF. This method was successfully applied for the analysis of Novafen capsule, with no interference from excipients as indicated by the recovery study results. The proposed method is simple and rapid and can be easily used in the quality control of drugs as an alternative analysis tools.

  13. Study of effects of transport properties of a biodiesel derived from soybean on the mixture process formation using CFD OpenFOAM

    Science.gov (United States)

    Benitez Molina, Adolfo; de La Garza de Leon, Oscar Alejandro; Martinez Martinez, Simon; Sanchez Cruz, Fausto Alejandro

    2015-03-01

    In this work has been studied the effects of the transport properties of biodiesel derived from soybean on the mixing process, using a CFD code OpenFOAM. For this the most relevant properties in this mixing process have been determined: density, viscosity, surface tension and vapor pressure. These fuel properties govern the spray formation however, there are only very limited studies that determined for its subsequent implementation in a CFD code, such as the OpenFOAM code. Such properties were obtained using empirical correlations based on the molecular structure of the fatty acids that compose the biodiesel and applying nonlinear regression are implemented in the programed models used in the OpenFOAM code for a diesel spray simulation. The results achieved in the present study on the one side, have been confirmed how the biodiesel properties affect the mixture process, and on the other side, the obtained coefficients which can be used in the proposed models by the CFD code OpenFOAM for the implementation of this properties as a temperature function without the correlations based on the molecular structure of the fatty acid. Also they thank the CONACYT from Mexican Government for granting the Master degree of Adolfo Benitez.

  14. Structural elucidation of biologically active neomycin N-octyl derivatives in a regioisomeric mixture by means of liquid chromatography/ion trap time-of-flight mass spectrometry.

    Science.gov (United States)

    Giera, Martin; de Vlieger, Jon S B; Lingeman, Henk; Irth, Hubertus; Niessen, Wilfried M A

    2010-05-30

    Structural elucidation of six regioisomers of mono-N-octyl derivatized neomycin is achieved using MS(n) (up to n = 4) on an ion trap time-of-flight (IT-TOF) instrument equipped with electrospray ionization. The mixture of six derivatized neomycin analogues was generated by reductive amination in a shotgun synthetic approach. In parallel to the liquid chromatography/mass spectrometry (LC/MS) detection, the antibacterial activity of the neomycin regioisomers was tested by post-column addition of buffer and bacterial inocula, subsequent microfractionation of the resulting mixture, incubation, and finally a chemiluminescence-based bioactivity measurement based on the production of bacterial ATP. The MS-based high-resolution screening approach described can be applied in medicinal chemistry to help in designing and producing new antibiotic substances, which is particularly challenging due to the high functionality of most antibiotic substances, therefore requiring advanced (hyphenated) separation and detection techniques for compound mixtures.

  15. Behavior of reaction mixtures under microwave conditions: Use of sodium salts in microwave-induced N-[[sup 18]F]fluoroalkylations of aporphine and tetralin derivatives

    Energy Technology Data Exchange (ETDEWEB)

    Zijlstra, S.; de Groot, T.J.; Kok, L.P.; Visser, G.M.; Vaalburg, W. (Univ. Hospital, Oostersingel, Groningen (Netherlands) Univ. of Groningen (Netherlands))

    1993-03-26

    In the present study, the authors have examined the behavior of reaction mixtures in a microwave field and the use of sodium salts to manipultate reaction rates. Three potential dopamine D[sub 2] agonists 2-[N-(3-[[sup 18]F]fluoropropyl)-N-[(4-fluorophenyl)ethyl]amino]-5-methoxytetralin (2), 6-(2-[[sup 18F

  16. Characterization of coal- and petroleum-derived binder pitches and the interaction of pitch/coke mixtures in pre-baked carbon anodes

    Science.gov (United States)

    Suriyapraphadilok, Uthaiporn

    Carbon anodes are manufactured from calcined petroleum coke (i.e. sponge coke) and recycled anode butts as fillers, and coal tar pitch (SCTP) as the binder. During the manufacturing of carbon anodes, coal tar pitch is mixed with calcined petroleum coke. The mix of binder, filler and some additives is heated to about 50°C above the softening point of the pitch, typically 160°C. This temperature is sufficient to enable the pitch to wet the coke particles. The mix is then either extruded, vibrated, or pressed to form a green anode. The binding between coke and pitch is very important to the anode properties. There are different binder pitches used in this work, which were standard coal tar pitch (SCTP-2), petroleum pitch (PP-1), gasification pitch (GP-115), coal-extract pitch (WVU-5), and co-coking pitches (HTCCP and OXCCP). Petroleum pitch is a residue produced from heat-treatment and distillation of petroleum fractions. Production of coal-extract pitch involves a prehydrogenation of coal followed by extraction using a dipolar solvent. Gasification pitches are distilled by-product tars produced from the coal gasification process. Co-coking pitch was developed in this work and was obtained from the liquid distillate of co-coking process of coal and heavy petroleum residue. Understanding of composition and structures of pitches from different sources and processes would lead to greater understanding of the binding properties of pitch in carbon anodes and was one of the main focuses in this study. Characterization of pitches by using different techniques including gas chromatography/mass spectrometry (GC/MS), high performance liquid chromatography (HPLC), matrix-assisted laser desorption ionization/mass spectrometry (MALDI/MS), 1H and 13C solution-state nuclear magnetic resonance (NMR), and 13C solid-state NMR yield important chemistry and structural information. The binding, or in other words the interactions in the pitch/coke mixture, is another interest in this

  17. Comparison of TLC and Different Micro TLC Techniques in Analysis of Tropane Alkaloids and Their Derivatives Mixture from Datura Inoxia Mill. Extract.

    Science.gov (United States)

    Malinowska, Irena; Studziński, Marek; Niezabitowska, Karolina; Gadzikowska, Maria

    2013-01-01

    Planar chromatography is a very useful tool for analysis of wide range of different mixtures. Thanks to its possibility for rapid separation of large number of samples simultaneously, low solvent consumption and ability to analyse rough material allow to receive precise and reliable results in short time and low cost. Miniaturization of planar techniques brings a lot of advantages, such as shortening distance and time of chromatogram development, and further lowering of solvent consumption. Besides, it often allows to improve separation parameters and raise efficiency of chromatographic system. In this paper, ability of analysis of tropane alkaloids mixture from Datura Inoxia Mill. extract using conventional TLC technique with five micro TLC techniques (short distance TLC, HPTLC, UTLC, OPLC and ETLC) in maximally closed chromatographic conditions was compared in order to present abilities of micro TLC techniques in plant material analysis.

  18. A mixture of bacterial mechanical lysates is more efficient than single strain lysate and of bacterial-derived soluble products for the induction of an activating phenotype in human dendritic cells.

    Science.gov (United States)

    Morandi, Barbara; Agazzi, Alessia; D'Agostino, Antonella; Antonini, Francesca; Costa, Gregorio; Sabatini, Federica; Ferlazzo, Guido; Melioli, Giovanni

    2011-07-01

    Dendritic cells (DCs), following an optimal maturation, are able to drive an efficient immune-response. For this, both co-stimulatory molecules (CD80 and CD86), activation molecules (CD83) and peptide presenting molecules (HLA) are over-expressed. The in vitro treatment of immature DC with fragments of bacterial strains, obtained by using a mechanical lysis as well as with bacterial-derived molecules (such as lipopolysaccharide and protido-glycan), induced the maturation of DCs and the secretion of a panel of cytokines and chemokines. Of note, ex vivo treated circulating DCs and plasmacytoid DCs were also activated by these bacterial bodies. However, while the particulate fraction of single bacterial strains or soluble bacterial-derived molecules induced a sub-optimal maturation (as evaluated by the expression of an activating phenotype on DCs and the amount of cytokine secretion), the addition of the mixture of the particulate fractions of the different bacterial strains was able to mediate an optimal maturation. These results were also confirmed by using the secretion of both cytokines and chemokines as markers of DC activation. All these findings suggest that the particulate fraction of bacterial lysate mixtures, because of their ability to interact with different surface structures, might be exploited not only as an immunogen, but also as an adjuvant treatment to boost an immune-response to poorly "antigenic" proteins, such as cancer antigens or allergens.

  19. Combustion, Performance, and Emission Evaluation of a Diesel Engine with Biodiesel Like Fuel Blends Derived From a Mixture of Pakistani Waste Canola and Waste Transformer Oils

    Directory of Open Access Journals (Sweden)

    Muhammad Qasim

    2017-07-01

    Full Text Available The aim of this work was to study the combustion, performance, and emission characteristics of a 5.5 kW four-stroke single-cylinder water-cooled direct-injection diesel engine operated with blends of biodiesel-like fuel (BLF15, BLF20 & BLF25 obtained from a 50:50 mixture of transesterified waste transformer oil (TWTO and waste canola oil methyl esters (WCOME with petroleum diesel. The mixture of the waste oils was named as biodiesel-like fuel (BLF.The engine fuelled with BLF blends was evaluated in terms of combustion, performance, and emission characteristics. FTIR analysis was carried out to know the functional groups in the BLF fuel. The experimental results revealed the shorter ignition delay and marginally higher brake specific fuel consumption (BSFC, brake thermal efficiency (BTE and exhaust gas temperature (EGT values for BLF blends as compared to diesel. The hydrocarbon (HC and carbon monoxide (CO emissions were decreased by 10.92–31.17% and 3.80–6.32%, respectively, as compared to those of diesel fuel. Smoke opacity was significantly reduced. FTIR analysis has confirmed the presence of saturated alkanes and halide groups in BLF fuel. In comparison to BLF20 and BLF25, the blend BLF15 has shown higher brake thermal efficiency and lower fuel consumption values. The HC, CO, and smoke emissions of BLF15 were found lower than those of petroleum diesel. The fuel blend BLF15 is suggested to be used as an alternative fuel for diesel engines without any engine modification.

  20. Determination of oxygen and nitrogen derivatives of polycyclic aromatic hydrocarbons in fractions of asphalt mixtures using liquid chromatography coupled to mass spectrometry with atmospheric pressure chemical ionization.

    Science.gov (United States)

    Nascimento, Paulo Cicero; Gobo, Luciana Assis; Bohrer, Denise; Carvalho, Leandro Machado; Cravo, Margareth Coutinho; Leite, Leni Figueiredo Mathias

    2015-12-01

    Liquid chromatography coupled to mass spectrometry with atmospheric pressure chemical ionization was used for the determination of polycyclic aromatic hydrocarbon derivatives, the oxygenated polycyclic aromatic hydrocarbons and nitrated polycyclic aromatic hydrocarbons, formed in asphalt fractions. Two different methods have been developed for the determination of five oxygenated and seven nitrated polycyclic aromatic hydrocarbons that are characterized by having two or more condensed aromatic rings and present mutagenic and carcinogenic properties. The parameters of the atmospheric pressure chemical ionization interface were optimized to obtain the highest possible sensitivity for all compounds. The detection limits of the methods ranged from 0.1 to 57.3 μg/L for nitrated and from 0.1 to 6.6 μg/L for oxygenated derivatives. The limits of quantification were in the range of 4.6-191 μg/L for nitrated and 0.3-8.9 μg/L for oxygenated derivatives. The methods were validated against a diesel particulate extract standard reference material (National Institute of Standards and Technology SRM 1975), and the obtained concentrations (two nitrated derivatives) agreed with the certified values. The methods were applied in the analysis of asphalt samples after their fractionation into asphaltenes and maltenes, according to American Society for Testing and Material D4124, where the maltenic fraction was further separated into its basic, acidic, and neutral parts following the method of Green. Only two nitrated derivatives were found in the asphalt sample, quinoline and 2-nitrofluorene, with concentrations of 9.26 and 2146 mg/kg, respectively, whereas no oxygenated derivatives were detected.

  1. Metabolic flux analysis of recombinant Pichia pastoris growing on different glycerol/methanol mixtures by iterative fitting of NMR-derived (13)C-labelling data from proteinogenic amino acids.

    Science.gov (United States)

    Jordà, Joel; de Jesus, Sérgio S; Peltier, Solenne; Ferrer, Pau; Albiol, Joan

    2014-01-25

    The yeast Pichia pastoris has emerged as one of the most promising yeast cell factories for the production of heterologous proteins. The readily available genetic tools and the ease of high-cell density cultivations using methanol or glycerol/methanol mixtures are among the key factors for this development. Previous studies have shown that the use of mixed feeds of glycerol and methanol seem to alleviate the metabolic burden derived from protein production, allowing for higher specific and volumetric process productivities. However, initial studies of glycerol/methanol co-metabolism in P. pastoris by classical metabolic flux analyses using (13)C-derived Metabolic Flux Ratio (METAFoR) constraints were hampered by the reduced labelling information obtained when using C3:C1 substrate mixtures in relation to the conventional C6 substrate, that is, glucose. In this study, carbon flux distributions through the central metabolic pathways in glycerol/methanol co-assimilation conditions have been further characterised using biosynthetically directed fractional (13)C labelling. In particular, metabolic flux distributions were obtained under 3 different glycerol/methanol ratios and growth rates by iterative fitting of NMR-derived (13)C-labelling data from proteinogenic amino acids using the software tool (13)CFlux2. Specifically, cells were grown aerobically in chemostat cultures fed with 80:20, 60:40 and 40:60 (w:w) glycerol/methanol mixtures at two dilutions rates (0.05 hour(-1) and 0.16 hour(-1)), allowing to obtain additional data (biomass composition and extracellular fluxes) to complement pre-existing datasets. The performed (13)C-MFA reveals a significant redistribution of carbon fluxes in the central carbon metabolism as a result of the shift in the dilution rate, while the ratio of carbon sources has a lower impact on carbon flux distribution in cells growing at the same dilution rate. At low growth rate, the percentage of methanol directly dissimilated to CO2 ranges

  2. Improvement in the repair of defects in maxillofacial soft tissue in irradiated minipigs by a mixture of adipose-derived stem cells and platelet-rich fibrin.

    Science.gov (United States)

    Chen, Yuanzheng; Niu, Zhanguo; Xue, Yan; Yuan, Fukang; Fu, Yanjie; Bai, Nan

    2014-10-01

    To find out if adipose-derived stem cells (ASC) and platelet-rich fibrin (PRF), alone or combined, had any effect on the repair of maxillofacial soft tissue defects in irradiated minipigs, ASC were isolated, characterised, and expanded. Twenty female minipigs, the right parotid glands of which had been irradiated, were randomly divided into 4 groups of 5 each: those in the first group were injected with both ASC and PRF (combined group), the second group was injected with ASC alone (ASC group), the third group with PRF alone (PRF group), and the fourth group with phosphate buffer saline (PBS) (control group). Six months after the last injection, the size and depth of each defect were assessed, and subcutaneous tissues were harvested, stained with haematoxylin and eosin, and examined immunohistologically and for apoptosis. Expanded cells were successfully isolated and identified. Six months after injection the defects in the 3 treated groups were significantly smaller (p<0.001) and shallower (p<0.001) than those in the control group. Those in the combined group were the smallest and shallowest. Haematoxylin and eosin showed that the 3 treated groups contained more subcutaneous adipose tissue than the control group, and also had significantly greater vascular density (p<0.001) and fewer apoptotic cells (p<0.001). Both ASC and PRF facilitate the repair of defects in maxillofacial soft tissue in irradiated minipigs, and their combined use is more effective than their use as single agents.

  3. Mixture Density Mercer Kernels

    Data.gov (United States)

    National Aeronautics and Space Administration — We present a method of generating Mercer Kernels from an ensemble of probabilistic mixture models, where each mixture model is generated from a Bayesian mixture...

  4. Shear viscosity of liquid mixtures Mass dependence

    CERN Document Server

    Kaushal, R

    2002-01-01

    Expressions for zeroth, second, and fourth sum rules of transverse stress autocorrelation function of two component fluid have been derived. These sum rules and Mori's memory function formalism have been used to study shear viscosity of Ar-Kr and isotopic mixtures. It has been found that theoretical result is in good agreement with the computer simulation result for the Ar-Kr mixture. The mass dependence of shear viscosity for different mole fraction shows that deviation from ideal linear model comes even from mass difference in two species of fluid mixture. At higher mass ratio shear viscosity of mixture is not explained by any of the emperical model.

  5. Mixtures of skewed Kalman filters

    KAUST Repository

    Kim, Hyoungmoon

    2014-01-01

    Normal state-space models are prevalent, but to increase the applicability of the Kalman filter, we propose mixtures of skewed, and extended skewed, Kalman filters. To do so, the closed skew-normal distribution is extended to a scale mixture class of closed skew-normal distributions. Some basic properties are derived and a class of closed skew. t distributions is obtained. Our suggested family of distributions is skewed and has heavy tails too, so it is appropriate for robust analysis. Our proposed special sequential Monte Carlo methods use a random mixture of the closed skew-normal distributions to approximate a target distribution. Hence it is possible to handle skewed and heavy tailed data simultaneously. These methods are illustrated with numerical experiments. © 2013 Elsevier Inc.

  6. Simultaneous determination of a ternary mixture of doxylamine succinate, pyridoxine hydrochloride, and folic acid by the ratio spectra-zero-crossing, double divisor-ratio spectra derivative, and column high-performance liquid chromatographic methods.

    Science.gov (United States)

    Pathak, Ashutosh; Rajput, Sadhana J

    2008-01-01

    Three simple, rapid, and accurate methods, i.e., the derivative ratio spectra-zero-crossing method (method I), double divisor-ratio spectra derivative method (method II), and column reversed-phase high-performance liquid chromatographic (RP-HPLC) method (method III) were developed for the simultaneous determination of doxylamine succinate (DOX), pyridoxine hydrochloride (PYR), and folic acid (FA) in their ternary mixtures and in tablets. In methods I and II, the calibration graphs were linear in the range of 2.5-80, 1.0-40, and 1.0-30 microg/mL for DOX, PYR, and FA, respectively. In the HPLC method, the separation of these compounds was performed using mobile phase consisting of 0.05 M phosphate buffer (pH 6.3)-methanol-acetonitrile (50 + 20 + 30, v/v/v), and UV detection was performed at 263 nm. Linearity was observed between the concentrations of the analytes and peak areas [correlation coefficient (r) > or =0.9998] in the concentration range of 1.0-200, 4.0-600, and 4.0-600 microg/mL for DOX, PYR, and FA, respectively. The standard deviation of retention time in method III was 0.011, 0.015, and 0.016 for DOX, PYR, and FA, respectively. The precision studies for all of the methods gave relative standard deviation values of <2%. The results obtained from the methods were statistically compared by means of Student's t-test and the variance ratio F-test. It was concluded that all of the developed methods were equally accurate, sensitive, and precise. These methods could be applied to determine DOX, PYR, and FA in their combined dosage forms.

  7. A novel spectral resolution and simultaneous determination of multicomponent mixture of Vitamins B1, B6, B12, Benfotiamine and Diclofenac in tablets and capsules by derivative and MCR-ALS.

    Science.gov (United States)

    Hegazy, Maha A; Abdelwahab, Nada S; Fayed, Ahmed S

    2015-04-05

    A novel method was developed for spectral resolution and further determination of five-component mixture including Vitamin B complex (B1, B6, B12 and Benfotiamine) along with the commonly co-formulated Diclofenac. The method is simple, sensitive, precise and could efficiently determine the five components by a complementary application of two different techniques. The first is univariate second derivative method that was successfully applied for determination of Vitamin B12. The second is Multivariate Curve Resolution using the Alternating Least Squares method (MCR-ALS) by which an efficient resolution and quantitation of the quaternary spectrally overlapped Vitamin B1, Vitamin B6, Benfotiamine and Diclofenac sodium were achieved. The effect of different constraints was studied and the correlation between the true spectra and the estimated spectral profiles were found to be 0.9998, 0.9983, 0.9993 and 0.9933 for B1, B6, Benfotiamine and Diclofenac, respectively. All components were successfully determined in tablets and capsules and the results were compared to HPLC methods and they were found to be statistically non-significant.

  8. Optimal mixture experiments

    CERN Document Server

    Sinha, B K; Pal, Manisha; Das, P

    2014-01-01

    The book dwells mainly on the optimality aspects of mixture designs. As mixture models are a special case of regression models, a general discussion on regression designs has been presented, which includes topics like continuous designs, de la Garza phenomenon, Loewner order domination, Equivalence theorems for different optimality criteria and standard optimality results for single variable polynomial regression and multivariate linear and quadratic regression models. This is followed by a review of the available literature on estimation of parameters in mixture models. Based on recent research findings, the volume also introduces optimal mixture designs for estimation of optimum mixing proportions in different mixture models, which include Scheffé’s quadratic model, Darroch-Waller model, log- contrast model, mixture-amount models, random coefficient models and multi-response model.  Robust mixture designs and mixture designs in blocks have been also reviewed. Moreover, some applications of mixture desig...

  9. A Specific Mixture of Fructo-Oligosaccharides and Bifidobacterium breve M-16V Facilitates Partial Non-Responsiveness to Whey Protein in Mice Orally Exposed to β-Lactoglobulin-Derived Peptides

    Science.gov (United States)

    Kostadinova, Atanaska I.; Meulenbroek, Laura A. P. M.; van Esch, Betty C. A. M.; Hofman, Gerard A.; Garssen, Johan; Willemsen, Linette E. M.; Knippels, Léon M. J.

    2017-01-01

    Oral tolerance is a promising approach for allergy prevention in early life, but it strongly depends on allergen exposure and proper immune environment. Small tolerance-inducing peptides and dietary immunomodulatory components may comprise an attractive method for allergy prevention in at-risk infants. This study aimed to investigate whether early oral exposure to β-lactoglobulin-derived peptides (BLG-peptides) and a specific synbiotic mixture of short- and long- chain fructo-oligosaccharides (scFOS/lcFOS, FF) and Bifidobacterium breve (Bb) M-16V (FF/Bb) can prevent cow’s milk allergy (CMA). Three-week-old female C3H/HeOuJ mice were orally exposed to phosphate buffered saline (PBS), whey protein, or a mixture of four synthetic BLG-peptides combined with a FF/Bb-enriched diet prior to intragastric sensitization with whey protein and cholera toxin. To assess the acute allergic skin response and clinical signs of allergy, mice were challenged intradermally with whole whey protein. Serum immunoglobulins were analyzed after a whey protein oral challenge. Cytokine production by allergen-reactivated splenocytes was measured and changes in T cells subsets in the spleen, mesenteric lymph nodes, and intestinal lamina propria were investigated. Pre-exposing mice to a low dosage of BLG-peptides and a FF/Bb-enriched diet prior to whey protein sensitization resulted in a significant reduction of the acute allergic skin response to whey compared to PBS-pretreated mice fed a control diet. Serum immunoglobulins were not affected, but anaphylactic symptom scores remained low and splenocytes were non-responsive in whey-induced cytokine production. In addition, preservation of the Th1/Th2 balance in the small intestine lamina propria was a hallmark of the mechanism underlying the protective effect of the BLG-peptides–FF/Bb intervention. Prior exposure to BLG-peptides and a FF/Bb-enriched diet is a promising approach for protecting the intestinal Th1/Th2 balance and reducing the

  10. Low temperature asphalt mixtures

    OpenAIRE

    Modrijan, Damjan

    2006-01-01

    This thesis presents the problem of manufacturing and building in the asphalt mixtures produced by the classical hot procedure and the possibility of manufacturing low temperature asphalt mixtures.We will see the main advantages of low temperature asphalt mixtures prepared with bitumen with organic addition Sasobit and compare it to the classical asphalt mixtures. The advantages and disadvantages of that are valued in the practical example in the conclusion.

  11. On the mixture model for multiphase flow

    Energy Technology Data Exchange (ETDEWEB)

    Manninen, M.; Taivassalo, V. [VTT Energy, Espoo (Finland). Nuclear Energy; Kallio, S. [Aabo Akademi, Turku (Finland)

    1996-12-31

    Numerical flow simulation utilising a full multiphase model is impractical for a suspension possessing wide distributions in the particle size or density. Various approximations are usually made to simplify the computational task. In the simplest approach, the suspension is represented by a homogeneous single-phase system and the influence of the particles is taken into account in the values of the physical properties. This study concentrates on the derivation and closing of the model equations. The validity of the mixture model is also carefully analysed. Starting from the continuity and momentum equations written for each phase in a multiphase system, the field equations for the mixture are derived. The mixture equations largely resemble those for a single-phase flow but are represented in terms of the mixture density and velocity. The volume fraction for each dispersed phase is solved from a phase continuity equation. Various approaches applied in closing the mixture model equations are reviewed. An algebraic equation is derived for the velocity of a dispersed phase relative to the continuous phase. Simplifications made in calculating the relative velocity restrict the applicability of the mixture model to cases in which the particles reach the terminal velocity in a short time period compared to the characteristic time scale of the flow of the mixture. (75 refs.)

  12. Liquids and liquid mixtures

    CERN Document Server

    Rowlinson, J S; Baldwin, J E; Buckingham, A D; Danishefsky, S

    2013-01-01

    Liquids and Liquid Mixtures, Third Edition explores the equilibrium properties of liquids and liquid mixtures and relates them to the properties of the constituent molecules using the methods of statistical thermodynamics. Topics covered include the critical state, fluid mixtures at high pressures, and the statistical thermodynamics of fluids and mixtures. This book consists of eight chapters and begins with an overview of the liquid state and the thermodynamic properties of liquids and liquid mixtures, including vapor pressure and heat capacities. The discussion then turns to the thermodynami

  13. Taylor dispersion analysis of mixtures.

    Science.gov (United States)

    Cottet, Hervé; Biron, Jean-Philippe; Martin, Michel

    2007-12-01

    Taylor dispersion analysis (TDA) is a fast and simple method for determining hydrodynamic radii. In the case of sample mixtures, TDA, as the other nonseparative methods, leads to an average diffusion coefficient on the different molecules constituting the mixture. We set in this work the equations giving, on a consistent basis, the average values obtained by TDA with detectors with linear response functions. These equations confronted TDA experiments of sample mixtures containing different proportions of a small molecule and a polymer standard. Very good agreement between theory and experiment was obtained. In a second part of this work, on the basis of monomodal or bimodal molar mass distributions of polymers, the different average diffusion coefficients corresponding to TDA were compared to the z-average diffusion coefficient (D(z)) obtained from dynamic light scattering (DLS) experiments and to the weight average diffusion coefficient (D(w)). This latter value is sometimes considered as the most representative of the sample mixture. From these results, it appears that, for monomodal distribution and relatively low polydispersity (I = 1.15), the average diffusion coefficient generally derived from TDA is very close to Dw. However, for highly polydisperse samples (e.g., bimodal polydisperse distributions), important differences could be obtained (up to 35% between TDA and D(w)). In all the cases, the average diffusion coefficient obtained by TDA for a mass concentration detector was closer to the Dw value than the z-average obtained by DLS.

  14. FRACTIONAL TRANSPORT OF SEDIMENT MIXTURES

    Institute of Scientific and Technical Information of China (English)

    Baosheng WU; Albert MOLINAS; Anping SHU

    2003-01-01

    A new method based on the Transport Capacity Fraction (TCF) concept is proposed to compute the fractional transport rates for nonuniform sediment mixtures in sand-bed channels. The TCF concept is derived from the understanding that the measurements and predictions of bed-material load are more accurate and reliable than the measurements and predictions of fractional loads. First the bed-material load is computed using an appropriate equation, then the fractional transport rates are determined by distributing the bed-material load into size groups through a transport capacity distribution function. For the computation of bed-material loads, the Aekers and White, Engelund and Hansen, and Yang equations are used in this study. Two new transport capacity distribution functions are developed for flows in sand-bed channels. The new expressions presented in this paper account for the sheltering and exposure effects that exist in mixtures. Comparisons with measured data show that the proposed method can significantly improve the predictions of fractional transport rates for nonuniform sediment mixtures.

  15. Perception of trigeminal mixtures.

    Science.gov (United States)

    Filiou, Renée-Pier; Lepore, Franco; Bryant, Bruce; Lundström, Johan N; Frasnelli, Johannes

    2015-01-01

    The trigeminal system is a chemical sense allowing for the perception of chemosensory information in our environment. However, contrary to smell and taste, we lack a thorough understanding of the trigeminal processing of mixtures. We, therefore, investigated trigeminal perception using mixtures of 3 relatively receptor-specific agonists together with one control odor in different proportions to determine basic perceptual dimensions of trigeminal perception. We found that 4 main dimensions were linked to trigeminal perception: sensations of intensity, warmth, coldness, and pain. We subsequently investigated perception of binary mixtures of trigeminal stimuli by means of these 4 perceptual dimensions using different concentrations of a cooling stimulus (eucalyptol) mixed with a stimulus that evokes warmth perception (cinnamaldehyde). To determine if sensory interactions are mainly of central or peripheral origin, we presented stimuli in a physical "mixture" or as a "combination" presented separately to individual nostrils. Results showed that mixtures generally yielded higher ratings than combinations on the trigeminal dimensions "intensity," "warm," and "painful," whereas combinations yielded higher ratings than mixtures on the trigeminal dimension "cold." These results suggest dimension-specific interactions in the perception of trigeminal mixtures, which may be explained by particular interactions that may take place on peripheral or central levels.

  16. A sealing mixture

    Energy Technology Data Exchange (ETDEWEB)

    Khayrullin, S.R.; Firsov, I.A.; Ongoyev, V.M.; Shekhtman, E.N.; Taskarin, B.T.

    1983-01-01

    A plugging mixture is proposed which contains triethanolamine, caustic soda, water and an additive. It is distinguished by the fact that in order to reduce the cost of the mixture while preserving its operational qualities, it additionally contains clay powder and as the additive, ground limestone with the following component ratio in percent by mass: ground limestone, 50 to 60; triethanolamine, 0.1 to 0.15; caustic soda, 2 to 3; clay powder, 8 to 10 and water the remainder. The mixture is distinguished by the fact that the ground limestone has a specific surface of 2,000 to 3,000 square centimeters per gram.

  17. Sol-gel derived sorbents

    Science.gov (United States)

    Sigman, Michael E.; Dindal, Amy B.

    2003-11-11

    Described is a method for producing copolymerized sol-gel derived sorbent particles for the production of copolymerized sol-gel derived sorbent material. The method for producing copolymerized sol-gel derived sorbent particles comprises adding a basic solution to an aqueous metal alkoxide mixture for a pH.ltoreq.8 to hydrolyze the metal alkoxides. Then, allowing the mixture to react at room temperature for a precalculated period of time for the mixture to undergo an increased in viscosity to obtain a desired pore size and surface area. The copolymerized mixture is then added to an immiscible, nonpolar solvent that has been heated to a sufficient temperature wherein the copolymerized mixture forms a solid upon the addition. The solid is recovered from the mixture, and is ready for use in an active sampling trap or activated for use in a passive sampling trap.

  18. Relativistic mixtures of charged and uncharged particles

    Energy Technology Data Exchange (ETDEWEB)

    Kremer, Gilberto M. [Departamento de Física, Universidade Federal do Paraná, Curitiba (Brazil)

    2014-01-14

    Mixtures of relativistic gases within the framework of Boltzmann equation are analyzed. Three systems are considered. The first one refers to a mixture of uncharged particles by using Grad’s moment method, where the relativistic mixture is characterized by the moments of the distribution functions: particle four-flows, energy-momentum tensors, and third-order moment tensors. In the second Fick’s law for a mixture of relativistic gases of non-disparate rest masses in a Schwarzschild metric are derived from an extension of Marle and McCormack model equations applied to a relativistic truncated Grad’s distribution function, where it is shown the dependence of the diffusion coefficient on the gravitational potential. The third one consists in the derivation of the relativistic laws of Ohm and Fourier for a binary mixtures of electrons with protons and electrons with photons subjected to external electromagnetic fields and in presence of gravitational fields by using the Anderson and Witting model of the Boltzmann equation.

  19. Microsiemens or Milligrams: Measures of Ionic Mixtures ...

    Science.gov (United States)

    In December of 2016, EPA released the Draft Field-Based Methods for Developing Aquatic Life Criteria for Specific Conductivity for public comment. Once final, states and authorized tribes may use these methods to derive field-based ecoregional ambient Aquatic Life Ambient Water Quality Criteria (AWQC) for specific conductivity (SC) in flowing waters. The methods provide flexible approaches for developing science-based SC criteria that reflect ecoregional or state specific factors. The concentration of a dissolved salt mixture can be measured in a number of ways including measurement of total dissolved solids, freezing point depression, refractive index, density, or the sum of the concentrations of individually measured ions. For the draft method, SC was selected as the measure because SC is a measure of all ions in the mixture; the measurement technology is fast, inexpensive, and accurate, and it measures only dissolved ions. When developing water quality criteria for major ions, some stakeholders may prefer to identify the ionic constituents as a measure of exposure instead of SC. A field-based method was used to derive example chronic and acute water quality criteria for SC and two anions a common mixture of ions (bicarbonate plus sulfate, [HCO3−] + [SO42−] in mg/L) that represent common mixtures in streams. These two anions are sufficient to model the ion mixture and SC (R2 = 0.94). Using [HCO3−] + [SO42−] does not imply that these two anions are the

  20. Microscopic Hydrodynamic Modes in a Binary Hard Sphere Mixture

    Science.gov (United States)

    Reichl, L. E.; Gust, Erich D.

    2017-07-01

    We derive analytic microscopic expressions for the shear viscosity, the speed of sound, and the decay rates of the hydrodynamic modes in a hard sphere binary gas mixture directly from the spectral properties of coupled Boltzmann equations. We show that the analytic expressions give good agreement with experimental viscosity data and to the results of light scattering experiments on noble gas binary mixtures.

  1. Coarsening Rates of Bicontinuous Structures in Polymer Mixtures

    NARCIS (Netherlands)

    Scholten, E.; Sagis, L.M.C.; Linden, van der E.

    2005-01-01

    We discuss the coarsening of domains in bicontinuous structure of aqueous polymer mixtures, driven by hydrodynamic flow. Taking into account the bending energy as a contribution to the interfacial energy, we derive a general expression for the coarsening rate in these mixtures. Examining the

  2. Homogeneous cooling of mixtures of particle shapes

    Science.gov (United States)

    Hidalgo, R. C.; Serero, D.; Pöschel, T.

    2016-07-01

    In this work, we examine theoretically the cooling dynamics of binary mixtures of spheres and rods. To this end, we introduce a generalized mean field analytical theory, which describes the free cooling behavior of the mixture. The relevant characteristic time scale for the cooling process is derived, depending on the mixture composition and the aspect ratio of the rods. We simulate mixtures of spherocylinders and spheres using a molecular dynamics algorithm implemented on graphics processing unit (GPU) architecture. We systematically study mixtures composed of spheres and rods with several aspect ratios and varying the mixture composition. A homogeneous cooling state, where the time dependence of the system's intensive variables occurs only through a global granular temperature, is identified. We find cooling dynamics in excellent agreement with Haff's law, when using an adequate time scale. Using the scaling properties of the homogeneous cooling dynamics, we estimated numerically the efficiency of the energy interchange between rotational and translational degrees of freedom for collisions between spheres and rods.

  3. Multilevel Mixture Kalman Filter

    Directory of Open Access Journals (Sweden)

    Xiaodong Wang

    2004-11-01

    Full Text Available The mixture Kalman filter is a general sequential Monte Carlo technique for conditional linear dynamic systems. It generates samples of some indicator variables recursively based on sequential importance sampling (SIS and integrates out the linear and Gaussian state variables conditioned on these indicators. Due to the marginalization process, the complexity of the mixture Kalman filter is quite high if the dimension of the indicator sampling space is high. In this paper, we address this difficulty by developing a new Monte Carlo sampling scheme, namely, the multilevel mixture Kalman filter. The basic idea is to make use of the multilevel or hierarchical structure of the space from which the indicator variables take values. That is, we draw samples in a multilevel fashion, beginning with sampling from the highest-level sampling space and then draw samples from the associate subspace of the newly drawn samples in a lower-level sampling space, until reaching the desired sampling space. Such a multilevel sampling scheme can be used in conjunction with the delayed estimation method, such as the delayed-sample method, resulting in delayed multilevel mixture Kalman filter. Examples in wireless communication, specifically the coherent and noncoherent 16-QAM over flat-fading channels, are provided to demonstrate the performance of the proposed multilevel mixture Kalman filter.

  4. Mixtures Estimation and Applications

    CERN Document Server

    Mengersen, Kerrie; Titterington, Mike

    2011-01-01

    This book uses the EM (expectation maximization) algorithm to simultaneously estimate the missing data and unknown parameter(s) associated with a data set. The parameters describe the component distributions of the mixture; the distributions may be continuous or discrete. The editors provide a complete account of the applications, mathematical structure and statistical analysis of finite mixture distributions along with MCMC computational methods, together with a range of detailed discussions covering the applications of the methods and features chapters from the leading experts on the subject

  5. Influences of urea–glycerol mixtures as mixed mesopore-controlling agents on tailoring physicochemical properties and photocatalytic H{sub 2} production activity of sol–gel-derived mesoporous-assembled TiO{sub 2} nanocrystals

    Energy Technology Data Exchange (ETDEWEB)

    Sreethawong, Thammanoon, E-mail: sreethawongt@imre.a-star.edu.sg [Institute of Materials Research and Engineering, Agency for Science, Technology and Research (A-STAR), 3 Research Link, Singapore 117602 (Singapore); Ngamsinlapasathian, Supachai, E-mail: wonone@hotmail.com [Institute of Advanced Energy, Kyoto University, Uji, Kyoto 611-0011 (Japan); Yoshikawa, Susumu [Institute of Advanced Energy, Kyoto University, Uji, Kyoto 611-0011 (Japan)

    2013-01-15

    Graphical abstract: Display Omitted Highlights: ► Mesoporous-assembled TiO{sub 2} nanocrystals were synthesized by modified sol–gel process. ► Urea–glycerol mixtures were applied as mixed mesopore-controlling agents. ► Urea and glycerol contents affected physicochemical properties of synthesized TiO{sub 2}. ► Photocatalytic H{sub 2} production activity also depended on urea and glycerol contents. ► 75 mol% urea and 25 mol% glycerol yielded the most photocatalytically active TiO{sub 2}. -- Abstract: In this work, the mesoporous-assembled TiO{sub 2} nanocrystal photocatalysts were successfully synthesized by a sol–gel process with the aid of urea–glycerol mixtures used as mixed mesopore-controlling agents. The photocatalytic activity of the synthesized mesoporous-assembled TiO{sub 2} nanocrystal photocatalysts was investigated for hydrogen production from the water splitting reaction using methanol as a hole scavenger under UV light irradiation. The synthesized TiO{sub 2} nanocrystal photocatalysts were systematically characterized by TG–DTA, N{sub 2} adsorption–desorption, SEM, high resolution TEM, and XRD analyses. The characterization results showed that the well-controlled contents of urea and glycerol in a urea–glycerol mixture at 75 mol% urea and 25 mol% glycerol resulted in not only the most highly porous network (i.e. the highest specific surface area and total pore volume, and the smallest mean mesopore diameter), but also the smallest crystallite size of the synthesized TiO{sub 2} nanocrystal photocatalyst. The photocatalytic reaction results, hence, revealed a much superior photocatalytic hydrogen production activity of the mesoporous-assembled TiO{sub 2} nanocrystal synthesized with 75 mol% urea and 25 mol% glycerol to the other synthesized TiO{sub 2} nanocrystals, also being much higher than those of the commercially available P-25 TiO{sub 2} and ST-01 TiO{sub 2} powders.

  6. Mixtures and interactions

    NARCIS (Netherlands)

    Groten, J.P.

    2000-01-01

    Drinking water can be considered as a complex mixture that consists of tens, hundreds or thousands of chemicals of which the composition is qualitatively and quantitatively not fully known. From a public health point of view it is most relevant to answer the question of whether chemicals in drinking

  7. Density, dynamic viscosity, and derived properties of binary mixtures of methanol or ethanol with water, ethyl acetate, and methyl acetate at T (293.15, 298.15, and 303.15) K

    Energy Technology Data Exchange (ETDEWEB)

    Gonzalez, Begona; Calvar, Noelia; Gomez, Elena [Chemical Engineering Department, University of Vigo, 36200 Vigo (Spain); Dominguez, Angeles [Chemical Engineering Department, University of Vigo, 36200 Vigo (Spain)], E-mail: admguez@uvigo.es

    2007-12-15

    Densities and dynamic viscosities for methanol or ethanol with water, ethyl acetate, and methyl acetate at several temperatures T = (293.15, 298.15, and 303.15) K have been measured over the whole composition range and 0.1 MPa, along with the properties of the pure components. Excess molar volumes, viscosity deviations, and excess free energy of activation for the binary systems at the above-mentioned temperatures, were calculated and fitted to the Redlich-Kister equation to determine the fitting parameters and the root-mean-square deviations. UNIQUAC equation was used to correlate the experimental viscosity data. The UNIFAC-VISCO method and ASOG-VISCO method, based on contribution groups, were used to predict the dynamic viscosities of the binary mixtures.

  8. Microwaves in chemistry: Another way of heating reaction mixtures

    Science.gov (United States)

    Berlan, J.

    1995-04-01

    The question of a possible "microwave activation" of chemical reaction is discussed. In fact two cases should be distinguished: homogeneous or heterogeneous reaction mixtures. In homogeneous mixtures there are no (or very low) rate enhancements compared to a conventional heating, but some influence on chemioselectivity has been observed. These effects derive from fast and mass heating of microwaves, and probably, especially under reflux, from different boiling rates and/or overheating. With heterogeneous mixtures non conventional effects probably derive from mass heating and selective overheating. This is illustrated with several reactions: Diels-Alder, naphthalene sulphonation, preparation of cyanuric acid, hydrolysis of nitriles, transposition reaction on solid support.

  9. A constitutive theory of reacting electrolyte mixtures

    Science.gov (United States)

    Costa Reis, Martina; Wang, Yongqi; Bono Maurizio Sacchi Bassi, Adalberto

    2013-11-01

    A constitutive theory of reacting electrolyte mixtures is formulated. The intermolecular interactions among the constituents of the mixture are accounted for through additional freedom degrees to each constituent of the mixture. Balance equations for polar reacting continuum mixtures are accordingly formulated and a proper set of constitutive equations is derived with basis in the Müller-Liu formulation of the second law of thermodynamics. Moreover, the non-equilibrium and equilibrium responses of the reacting mixture are investigated in detail by emphasizing the inner and reactive structures of the medium. From the balance laws and constitutive relations, the effects of molecular structure of constituents upon the fluid flow are studied. It is also demonstrated that the local thermodynamic equilibrium state can be reached without imposing that the set of independent constitutive variables is time independent, neither spatially homogeneous nor null. The resulting constitutive relations presented throughout this work are of relevance to many practical applications, such as swelling of clays, developing of bio and polymeric membranes, and use of electrorheological fluids in industrial processes. The first author acknowledges financial support from National Counsel of Technological and Scientific Development (CNPq) and German Academic Exchange Service (DAAD).

  10. The Supervised Learning Gaussian Mixture Model

    Institute of Scientific and Technical Information of China (English)

    马继涌; 高文

    1998-01-01

    The traditional Gaussian Mixture Model(GMM)for pattern recognition is an unsupervised learning method.The parameters in the model are derived only by the training samples in one class without taking into account the effect of sample distributions of other classes,hence,its recognition accuracy is not ideal sometimes.This paper introduces an approach for estimating the parameters in GMM in a supervising way.The Supervised Learning Gaussian Mixture Model(SLGMM)improves the recognition accuracy of the GMM.An experimental example has shown its effectiveness.The experimental results have shown that the recognition accuracy derived by the approach is higher than those obtained by the Vector Quantization(VQ)approach,the Radial Basis Function (RBF) network model,the Learning Vector Quantization (LVQ) approach and the GMM.In addition,the training time of the approach is less than that of Multilayer Perceptrom(MLP).

  11. Pointer Sentinel Mixture Models

    OpenAIRE

    Merity, Stephen; Xiong, Caiming; Bradbury, James; Socher, Richard

    2016-01-01

    Recent neural network sequence models with softmax classifiers have achieved their best language modeling performance only with very large hidden states and large vocabularies. Even then they struggle to predict rare or unseen words even if the context makes the prediction unambiguous. We introduce the pointer sentinel mixture architecture for neural sequence models which has the ability to either reproduce a word from the recent context or produce a word from a standard softmax classifier. O...

  12. Essays on Finite Mixture Models

    NARCIS (Netherlands)

    A. van Dijk (Bram)

    2009-01-01

    textabstractFinite mixture distributions are a weighted average of a ¯nite number of distributions. The latter are usually called the mixture components. The weights are usually described by a multinomial distribution and are sometimes called mixing proportions. The mixture components may be the

  13. Essays on Finite Mixture Models

    NARCIS (Netherlands)

    A. van Dijk (Bram)

    2009-01-01

    textabstractFinite mixture distributions are a weighted average of a ¯nite number of distributions. The latter are usually called the mixture components. The weights are usually described by a multinomial distribution and are sometimes called mixing proportions. The mixture components may be the sam

  14. Mixtures of truncated basis functions

    DEFF Research Database (Denmark)

    Langseth, Helge; Nielsen, Thomas Dyhre; Rumí, Rafael

    2012-01-01

    In this paper we propose a framework, called mixtures of truncated basis functions (MoTBFs), for representing general hybrid Bayesian networks. The proposed framework generalizes both the mixture of truncated exponentials (MTEs) framework and the mixture of polynomials (MoPs) framework. Similar...

  15. Separating Underdetermined Convolutive Speech Mixtures

    DEFF Research Database (Denmark)

    Pedersen, Michael Syskind; Wang, DeLiang; Larsen, Jan

    2006-01-01

    a method for underdetermined blind source separation of convolutive mixtures. The proposed framework is applicable for separation of instantaneous as well as convolutive speech mixtures. It is possible to iteratively extract each speech signal from the mixture by combining blind source separation...

  16. Toxicological evaluation of chemical mixtures

    NARCIS (Netherlands)

    Feron, V.J.; Groten, J.P.

    2002-01-01

    This paper addresses major developments in the safety evaluation of chemical mixtures during the past 15 years, reviews today's state of the art of mixture toxicology, and discusses challenges ahead. Well-thought-out tailor-made mechanistic and empirical designs for studying the toxicity of mixtures

  17. Mixture Based Outlier Filtration

    Directory of Open Access Journals (Sweden)

    P. Pecherková

    2006-01-01

    Full Text Available Success/failure of adaptive control algorithms – especially those designed using the Linear Quadratic Gaussian criterion – depends on the quality of the process data used for model identification. One of the most harmful types of process data corruptions are outliers, i.e. ‘wrong data’ lying far away from the range of real data. The presence of outliers in the data negatively affects an estimation of the dynamics of the system. This effect is magnified when the outliers are grouped into blocks. In this paper, we propose an algorithm for outlier detection and removal. It is based on modelling the corrupted data by a two-component probabilistic mixture. The first component of the mixture models uncorrupted process data, while the second models outliers. When the outlier component is detected to be active, a prediction from the uncorrupted data component is computed and used as a reconstruction of the observed data. The resulting reconstruction filter is compared to standard methods on simulated and real data. The filter exhibits excellent properties, especially in the case of blocks of outliers. 

  18. Theory of dynamic arrest in colloidal mixtures.

    Science.gov (United States)

    Juárez-Maldonado, R; Medina-Noyola, M

    2008-05-01

    We present a first-principles theory of dynamic arrest in colloidal mixtures based on the multicomponent self-consistent generalized Langevin equation theory of colloid dynamics [M. A. Chávez-Rojo and M. Medina-Noyola, Phys. Rev. E 72, 031107 (2005); M. A. Chávez-Rojo and M. Medina-Noyola, Phys. Rev. E76, 039902 (2007)]. We illustrate its application with a description of dynamic arrest in two simple model colloidal mixtures: namely, hard-sphere and repulsive Yukawa binary mixtures. Our results include observation of the two patterns of dynamic arrest, one in which both species become simultaneously arrested and the other involving the sequential arrest of the two species. The latter case gives rise to mixed states in which one species is arrested while the other species remains mobile. We also derive the ("bifurcation" or fixed-point") equations for the nonergodic parameters of the system, which takes the surprisingly simple form of a system of coupled equations for the localization length of the particles of each species. The solution of this system of equations indicates unambiguously which species is arrested (finite localization length) and which species remains ergodic (infinite localization length). As a result, we are able to draw the entire ergodic-nonergodic phase diagram of the binary hard-sphere mixture.

  19. Combustion of soybean oil and diesel mixtures for heating purposes

    Energy Technology Data Exchange (ETDEWEB)

    Guimaraes, Adriana Correa; Sanz, Jose Francisco [European University Miguel de Cervantes, Valladolid (Spain)], E-mail: acorrea@uemc.es; Hernandez, Salvador; Navas, Luis Manuel; Rodriguez, Elena; Ruiz, Gonzalo [University of Valladolid (Spain). Dept. of Agricultural and Forest Engineering; San Jose, Julio [University of Valladolid (Spain). Dept. of Energetic Engineering; Gomez, Jaime [University of Valladolid (Spain). Dept. of Communications and Signal Theory and Telematics Engineering

    2008-07-01

    Using blends of vegetable oils with petroleum derivates for heating purposes has several advantages over other energy application for vegetable oils. This paper presents the results of an investigation by use of soybean oil and diesel mixture as fuel for producing heat in conventional diesel installation. The paper is set out as follows: properties characterization of soybean oil as fuel and of diesel oil, as well as the mixture of both; selection of the mixture according to their physical chemical properties and how they adapt to conventional combustion installation; experimentation with the selected mixture, allowing the main combustion parameters to be measured; processing the collected data, values of combustion, efficiency and reduction of emissions. Conclusions show that the use of soybean oil and diesel mixture for producing heat energy in conventional equipment is feasible and beneficial for reduction emissions. (author)

  20. Effects of Mixing on Hopper Sedimentation in Clearing Mixtures

    DEFF Research Database (Denmark)

    Hjelmager Jensen, Jacob; Saremi, Sina

    2015-01-01

    and settling in high-concentration mixtures were examined theoretically. Analytical solutions for clearance of excess concentrations were derived for the limiting cases of (1) still-water clearance and (2) clearance when the amount of turbulence is abundant. When examining these analytical solutions......Hopper sedimentation is the result of precipitation of typically fine sediment from a homogenous, high-concentration mixture, which is not completely deficient of turbulence. If hopper sedimentation or loading is accomplished through a single-inflow system, or if the irregularity of the inflow...... concentrations is pronounced or simply terminated, then the hopper mixture will clear. Whereas turbulent mixing is redundant, when the mixture is homogeneous, it may take an active role when the mixture is clearing. The role of turbulence on hopper sedimentation has been the focus of several studies...

  1. Realistic environmental mixtures of micropollutants in surface, drinking, and recycled water: herbicides dominate the mixture toxicity toward algae.

    Science.gov (United States)

    Tang, Janet Y M; Escher, Beate I

    2014-06-01

    Mixture toxicity studies with herbicides have focused on a few priority components that are most likely to cause environmental impacts, and experimental mixtures were often designed as equipotent mixtures; however, real-world mixtures are made up of chemicals with different modes of toxic action at arbitrary concentration ratios. The toxicological significance of environmentally realistic mixtures has only been scarcely studied. Few studies have simultaneously compared the mixture effect of water samples with designed reference mixtures comprised of the ratios of analytically detected concentrations in toxicity tests. In the present study, the authors address the effect of herbicides and other chemicals on inhibition of photosynthesis and algal growth rate. The authors tested water samples including secondary treated wastewater effluent, recycled water, drinking water, and storm water in the combined algae assay. The detected chemicals were mixed in the concentration ratios detected, and the biological effects of the water samples were compared with the designed mixtures of individual detected chemicals to quantify the fraction of effect caused by unknown chemicals. The results showed that herbicides dominated the algal toxicity in these environmentally realistic mixtures, and the contribution by the non-herbicides was negligible. A 2-stage model, which used concentration addition within the groups of herbicides and non-herbicides followed by the model of independent action to predict the mixture effect of the two groups, could predict the experimental mixture toxicity effectively, but the concentration addition model for herbicides was robust and sufficient for complex mixtures. Therefore, the authors used the bioanalytical equivalency concept to derive effect-based trigger values for algal toxicity for monitoring water quality in recycled and surface water. All water samples tested would be compliant with the proposed trigger values associated with the

  2. Concomitant variables in finite mixture models

    NARCIS (Netherlands)

    Wedel, M

    The standard mixture model, the concomitant variable mixture model, the mixture regression model and the concomitant variable mixture regression model all enable simultaneous identification and description of groups of observations. This study reviews the different ways in which dependencies among

  3. Excess compressibility in binary liquid mixtures.

    Science.gov (United States)

    Aliotta, F; Gapiński, J; Pochylski, M; Ponterio, R C; Saija, F; Salvato, G

    2007-06-14

    Brillouin scattering experiments have been carried out on some mixtures of molecular liquids. From the measurement of the hypersonic velocities we have evaluated the adiabatic compressibility as a function of the volume fraction. We show how the quadratic form of the excess compressibility dependence on the solute volume fraction can be derived by simple statistical effects and does not imply any interaction among the components of the system other than excluded volume effects. This idea is supported by the comparison of the experimental results with a well-established prototype model, consisting of a binary mixture of hard spheres with a nonadditive interaction potential. This naive model turns out to be able to produce a very wide spectrum of structural and thermodynamic features depending on values of its parameters. An attempt has made to understand what kind of structural information can be gained through the analysis of the volume fraction dependence of the compressibility.

  4. Protein mixtures: interactions and gelation

    OpenAIRE

    Ersch, C.

    2015-01-01

    Gelation is a ubiquitous process in the preparation of foods. As most foods are multi constituent mixtures, understanding gelation in mixtures is an important goal in food science. Here we presented a systematic investigation on the influence of molecular interactions on the gelation in protein mixtures. Gelatin gels with added globular protein and globular protein gels with added gelatin were analyzed for their gel microstructure and rheological properties. Mixed gels with altered microstruc...

  5. Partitioning regularity of non-ionic organic mixtures in organic phase/water system

    Institute of Scientific and Technical Information of China (English)

    2001-01-01

    The partitioning regularity of nonionic organic mixtures in organic phase/water system is revealed. The equation for calculating the partition coefficients of mixtures (KMD), together with the determination model, is derived from the equilibrium partitioning models (EPMs). Based on these derived equations, the KMD values of 20 mixtures conraining halogenated benzenes are obtained. The results show that stronger hydrophobicity of an individual chemical in the mixture results in the stronger hydrophobicity of the mixture and the greater the proportion of this chemical, the stronger the hydrophobicity of the mixture will be. This partitioning regularity is helpful to the study of the toxicity for mixtures and the environmental behavior, such as transfer or accumuiation, for mixed organic pollutants.``

  6. Neurotoxicity of Metal Mixtures.

    Science.gov (United States)

    Andrade, V M; Aschner, M; Marreilha Dos Santos, A P

    2017-01-01

    Metals are the oldest toxins known to humans. Metals differ from other toxic substances in that they are neither created nor destroyed by humans (Casarett and Doull's, Toxicology: the basic science of poisons, 8th edn. McGraw-Hill, London, 2013). Metals are of great importance in our daily life and their frequent use makes their omnipresence and a constant source of human exposure. Metals such as arsenic [As], lead [Pb], mercury [Hg], aluminum [Al] and cadmium [Cd] do not have any specific role in an organism and can be toxic even at low levels. The Substance Priority List of Agency for Toxic Substances and Disease Registry (ATSDR) ranked substances based on a combination of their frequency, toxicity, and potential for human exposure. In this list, As, Pb, Hg, and Cd occupy the first, second, third, and seventh positions, respectively (ATSDR, Priority list of hazardous substances. U.S. Department of Health and Human Services, Public Health Service, Atlanta, 2016). Besides existing individually, these metals are also (or mainly) found as mixtures in various parts of the ecosystem (Cobbina SJ, Chen Y, Zhou Z, Wub X, Feng W, Wang W, Mao G, Xu H, Zhang Z, Wua X, Yang L, Chemosphere 132:79-86, 2015). Interactions among components of a mixture may change toxicokinetics and toxicodynamics (Spurgeon DJ, Jones OAH, Dorne J-L, Svendsen C, Swain S, Stürzenbaum SR, Sci Total Environ 408:3725-3734, 2010) and may result in greater (synergistic) toxicity (Lister LJ, Svendsen C, Wright J, Hooper HL, Spurgeon DJ, Environ Int 37:663-670, 2011). This is particularly worrisome when the components of the mixture individually attack the same organs. On the other hand, metals such as manganese [Mn], iron [Fe], copper [Cu], and zinc [Zn] are essential metals, and their presence in the body below or above homeostatic levels can also lead to disease states (Annangi B, Bonassi S, Marcos R, Hernández A, Mutat Res 770(Pt A):140-161, 2016). Pb, As, Cd, and Hg can induce Fe, Cu, and Zn

  7. Thermophysical Properties of Hydrocarbon Mixtures

    Science.gov (United States)

    SRD 4 NIST Thermophysical Properties of Hydrocarbon Mixtures (PC database for purchase)   Interactive computer program for predicting thermodynamic and transport properties of pure fluids and fluid mixtures containing up to 20 components. The components are selected from a database of 196 components, mostly hydrocarbons.

  8. Evaporating Drops of Alkane Mixtures

    OpenAIRE

    Guéna, Geoffroy; Poulard, Christophe; Cazabat, Anne-Marie

    2005-01-01

    22 pages 9 figures; Alkane mixtures are model systems where the influence of surface tension gradients during the spreading and the evaporation of wetting drops can be easily studied. The surface tension gradients are mainly induced by concentration gradients, mass diffusion being a stabilising process. Depending on the relative concentration of the mixture, a rich pattern of behaviours is obtained.

  9. Protein mixtures: interactions and gelation

    NARCIS (Netherlands)

    Ersch, C.

    2015-01-01

    Gelation is a ubiquitous process in the preparation of foods. As most foods are multi constituent mixtures, understanding gelation in mixtures is an important goal in food science. Here we presented a systematic investigation on the influence of molecular interactions on the gelation in protein mixt

  10. Evaporating Drops of Alkane Mixtures

    CERN Document Server

    Gu'ena, G; Poulard, C; Cazabat, Anne-Marie; Gu\\'{e}na, Geoffroy; Poulard, Christophe

    2005-01-01

    Alkane mixtures are model systems where the influence of surface tension gradients during the spreading and the evaporation of wetting drops can be easily studied. The surface tension gradients are mainly induced by concentration gradients, mass diffusion being a stabilising process. Depending on the relative concentration of the mixture, a rich pattern of behaviours is obtained.

  11. Protein mixtures: interactions and gelation

    NARCIS (Netherlands)

    Ersch, C.

    2015-01-01

    Gelation is a ubiquitous process in the preparation of foods. As most foods are multi constituent mixtures, understanding gelation in mixtures is an important goal in food science. Here we presented a systematic investigation on the influence of molecular interactions on the gelation in protein mixt

  12. Easy and flexible mixture distributions

    DEFF Research Database (Denmark)

    Fosgerau, Mogens; Mabit, Stefan L.

    2013-01-01

    We propose a method to generate flexible mixture distributions that are useful for estimating models such as the mixed logit model using simulation. The method is easy to implement, yet it can approximate essentially any mixture distribution. We test it with good results in a simulation study...

  13. Statistical mechanical theory of fluid mixtures

    Science.gov (United States)

    Zhao, Yueqiang; Wu, Zhengming; Liu, Weiwei

    2014-01-01

    A general statistical mechanical theory of fluid mixtures (liquid mixtures and gas mixtures) is developed based on the statistical mechanical expression of chemical potential of components in the grand canonical ensemble, which gives some new relationships between thermodynamic quantities (equilibrium ratio Ki, separation factor α and activity coefficient γi) and ensemble average potential energy u for one molecule. The statistical mechanical expressions of separation factor α and activity coefficient γi derived in this work make the fluid phase equilibrium calculations can be performed by molecular simulation simply and efficiently, or by the statistical thermodynamic approach (based on the saturated-vapor pressure of pure substance) that does not need microscopic intermolecular pair potential functions. The physical meaning of activity coefficient γi in the liquid phase is discussed in detail from a viewpoint of molecular thermodynamics. The calculated Vapor-Liquid Equilibrium (VLE) properties of argon-methane, methanol-water and n-hexane-benzene systems by this model fit well with experimental data in references, which indicates that this model is accurate and reliable in the prediction of VLE properties for small, large and strongly associating molecules; furthermore the statistical mechanical expressions of separation factor α and activity coefficient γi have good compatibility with classical thermodynamic equations and quantum mechanical COSMO-SAC approach.

  14. Sensitivity of Some Explosive/Brine Mixtures

    Science.gov (United States)

    1980-08-01

    concentration in brine mixtures. 3 Friction test results of brine mixtures. 10 4 Thermal test results of brine mixtures. 11 Li 71 - INTRODUCTION A...also carried out on these impact insensitive mixtures. Of the seven mixtures only the 15% M28-Comp. B sample passed the thermal test , since smoking

  15. Phase behavior and structure of binary hard-sphere mixtures

    NARCIS (Netherlands)

    Dijkstra, Marjolein; Roij, R. van; Evans, R.

    1998-01-01

    By integrating out the degrees of freedom of the small spheres in a binary mixture of large and small hard spheres, we derive an explicit effective Hamiltonian for the large spheres. Using the two-body (depletion potential) contribution to this effective Hamiltonian in simulations, we find stable

  16. Phase diagram of highly asymmetric binary hardsphere mixtures

    NARCIS (Netherlands)

    Dijkstra, M.|info:eu-repo/dai/nl/123538807; van Roij, R.H.H.G.|info:eu-repo/dai/nl/152978984; Evans, R.

    We study the phase behavior and structure of highly asymmetric binary hard-sphere mixtures. By first integrating out the degrees of freedom of the small spheres in the partition function we derive a formal expression for the effective Hamiltonian of the large spheres. Then using an explicit pairwise

  17. Optimal Parameters Multicomponent Mixtures Extruding

    Directory of Open Access Journals (Sweden)

    Ramil F. Sagitov

    2013-01-01

    Full Text Available Experimental research of multicomponent mixtures extruding from production wastes are carried out, unit for production of composites from different types of waste is presented. Having analyzed dependence of multicomponent mixtures extruding energy requirements on die length and components content at three values of angular rate of screw rotation, we received the values of energy requirements at optimal length of the die, angular speed and percent of binding additives.

  18. Gaussian-mixture umbrella sampling

    OpenAIRE

    Maragakis, Paul; van der Vaart, Arjan; Karplus, Martin

    2009-01-01

    We introduce the Gaussian-mixture umbrella sampling method (GAMUS), a biased molecular dynamics technique based on adaptive umbrella sampling that efficiently escapes free energy minima in multi-dimensional problems. The prior simulation data are reweighted with a maximum likelihood formulation, and the new approximate probability density is fit to a Gaussian-mixture model, augmented by information about the unsampled areas. The method can be used to identify free energy minima in multi-dimen...

  19. Analysis of asphalt mixtures on town roads

    OpenAIRE

    Glavica, Primož

    2006-01-01

    Asphalt mixtures are most commonly used composite for construction of top layers of different drive ways. By definition asphalt mixtures are composed of crushed rock, fill, bitumen and additives. Percentage of individual components wary according to the purpose asphalt mixture is to be used for. Asphalt mixtures must be capable of enduring different types of load. According to the type of load asphalt mixtures are divided into asphalt mixtures used for supporting layers and asp...

  20. Osteogenesis of human adipose-derived mesenchymal stem cells-biomaterial mixture in vivo after 3 D bio-printing%人脂肪间充质干细胞与生物材料共混物三维打印体的体内成骨

    Institute of Scientific and Technical Information of China (English)

    宋杨; 王晓飞; 王宇光; 孙玉春; 吕培军

    2016-01-01

    Objective:To construct human adipose-derived mesenchymal stem cells (hASCs)-biomate-rial mixture 3D bio-printing body and detect its osteogenesis in vivo,and to establish a guideline of osteogenesis in vivo by use of 3D bio-printing technology preliminarily.Methods:P4 hASCs were used as seed cells,whose osteogenic potential in vitro was tested by alkaline phosphatase (ALP)staining and alizarin red staining after 1 4 d of osteogenic induction.The cells were added into 20 g/L sodium alginate and 80 g/L gelatin mixture (cell density was 1 ×1 06/mL),and the cell-sodium alginate-gelatin mixture was printed by Bioplotter 3D bio-printer (Envision company,Germany),in which the cells’survival rate was detected by live-dead cell double fluorescence staining.Next,the printing body was osteogeni-cally induced for 1 week to gain the experimental group;and the sodium alginate-gelatin mixture without cells was also printed to gain the control group.Both the experimental group and the control group were implanted into the back of the nude mice.After 6 weeks of implantation,the samples were collected,HE staining,Masson staining,immunohistochemical staining and Inveon Micro CT test were preformed to analyze their osteogenic capability.Results:The cells’survival rate was 89%±2% after printing.Six weeks after implantation,the samples of the control group were mostly degraded,whose shape was irregu-lar and gel-like;the samples of the experimental group kept their original size and their texture was tough.HE staining and Masson staining showed that the bone-like tissue and vessel in-growth could be observed in the experimental group 6 weeks after implantation,immunohistochemical staining showed that the result of osteocalcin was positive,and Micro CT results showed that samples of the experimental group had a higher density and the new bone volume was 1 8%±1%.Conclusion:hASCs-biomaterial mixture 3D bio-printing body has capability of ectopic bone formation in nude mice,and it is

  1. Characteristic functions of scale mixtures of multivariate skew-normal distributions

    KAUST Repository

    Kim, Hyoung-Moon

    2011-08-01

    We obtain the characteristic function of scale mixtures of skew-normal distributions both in the univariate and multivariate cases. The derivation uses the simple stochastic relationship between skew-normal distributions and scale mixtures of skew-normal distributions. In particular, we describe the characteristic function of skew-normal, skew-t, and other related distributions. © 2011 Elsevier Inc.

  2. Computation of the acoustic nonlinearity parameter in organic liquid binary mixtures

    Institute of Scientific and Technical Information of China (English)

    2000-01-01

    Based on Jacobson's molecular free length theory in liquids and the relationship between the ultrasonic velocity and the molecular free length in organic liquids,the equation of the acoustic nonlinearity parameter in organic liquid binary mixtures is derived.The calculated values from the equation are in good agreement both with those from Apfel's and from Sehgal's mixture laws.

  3. Combinatorial bounds on the α-divergence of univariate mixture models

    KAUST Repository

    Nielsen, Frank

    2017-06-20

    We derive lower- and upper-bounds of α-divergence between univariate mixture models with components in the exponential family. Three pairs of bounds are presented in order with increasing quality and increasing computational cost. They are verified empirically through simulated Gaussian mixture models. The presented methodology generalizes to other divergence families relying on Hellinger-type integrals.

  4. Predicting minimum fluidization velocities of multi-component solid mixtures

    Institute of Scientific and Technical Information of China (English)

    Mohammad Asif

    2013-01-01

    Employing well-established mixing rules for mean properties,appropriate expressions are aerivea for predicting minimum fluidization velocities of multi-component solid mixtures in terms of monocomponent values for the velocity and the bed voidage at incipient fluidization.Based on flow regime and the mixing level of constituent species,it is found that these relationships differ significantly from each other,whether related to size-different or density-different mixtures.For mixed beds of size-different mixtures,the effect of volume contraction is accounted for by the mean voidage term,which is absent for segregated beds.Incorporating the volume-change of mixing leads to values of the mixture minimum fluidization velocities even lower than corresponding values for segregated bed,thus conforming to the trend reported in the literature.Size-different mixtures exhibit flow regime dependence irrespective of whether the bed is mixed or segregated.On the other hand,the mixing of constituent species does not affect the minimum fluidization velocity of density-different mixtures,as the difference in the expressions for a segregated and a mixed system is rather inconsequential.Comparison with experimental data available in the literature is made to test the efficacy of the minimum fluidization velocity expressions derived here.

  5. Density measurements of compressed-liquid dimethyl ether + pentane mixtures.

    Science.gov (United States)

    Outcalt, Stephanie L; Lemmon, Eric W

    2016-01-01

    Compressed-liquid densities of three compositions of the binary mixture dimethyl ether (CAS No. 115-10-6) + pentane (CAS No. 109-66-0) have been measured with a vibrating U-tube densimeter. Measurements were made at temperatures from 270 K to 390 K with pressures from 1.0 MPa to 50 MPa. The overall combined uncertainty (k=2) of the density data is 0.81 kg·m(-3). Data presented here have been used to improve a previously formulated Helmholtz energy based mixture model. The newly derived parameters are given.

  6. Density functional for ternary non-additive hard sphere mixtures.

    Science.gov (United States)

    Schmidt, Matthias

    2011-10-19

    Based on fundamental measure theory, a Helmholtz free energy density functional for three-component mixtures of hard spheres with general, non-additive interaction distances is constructed. The functional constitutes a generalization of the previously given theory for binary non-additive mixtures. The diagrammatic structure of the spatial integrals in both functionals is of star-like (or tree-like) topology. The ternary diagrams possess a higher degree of complexity than the binary diagrams. Results for partial pair correlation functions, obtained via the Ornstein-Zernike route from the second functional derivatives of the excess free energy functional, agree well with Monte Carlo simulation data. © 2011 IOP Publishing Ltd

  7. Marangoni Convection in Binary Mixtures

    CERN Document Server

    Zhang, J; Oron, A; Behringer, Robert P.; Oron, Alexander; Zhang, Jie

    2006-01-01

    Marangoni instabilities in binary mixtures are different from those in pure liquids. In contrast to a large amount of experimental work on Marangoni convection in pure liquids, such experiments in binary mixtures are not available in the literature, to our knowledge. Using binary mixtures of sodium chloride/water, we have systematically investigated the pattern formation for a set of substrate temperatures and solute concentrations in an open system. The flow patterns evolve with time, driven by surface-tension fluctuations due to evaporation and the Soret effect, while the air-liquid interface does not deform. A shadowgraph method is used to follow the pattern formation in time. The patterns are mainly composed of polygons and rolls. The mean pattern size first decreases slightly, and then gradually increases during the evolution. Evaporation affects the pattern formation mainly at the early stage and the local evaporation rate tends to become spatially uniform at the film surface. The Soret effect becomes i...

  8. Bayesian Estimation of a Mixture Model

    Directory of Open Access Journals (Sweden)

    Ilhem Merah

    2015-05-01

    Full Text Available We present the properties of a bathtub curve reliability model having both a sufficient adaptability and a minimal number of parameters introduced by Idée and Pierrat (2010. This one is a mixture of a Gamma distribution G(2, (1/θ and a new distribution L(θ. We are interesting by Bayesian estimation of the parameters and survival function of this model with a squared-error loss function and non-informative prior using the approximations of Lindley (1980 and Tierney and Kadane (1986. Using a statistical sample of 60 failure data relative to a technical device, we illustrate the results derived. Based on a simulation study, comparisons are made between these two methods and the maximum likelihood method of this two parameters model.

  9. Continuum thermodynamics of chemically reacting fluid mixtures

    CERN Document Server

    Bothe, Dieter

    2014-01-01

    We consider viscous and heat conducting mixtures of molecularly miscible chemical species forming a fluid in which the constituents can undergo chemical reactions. Assuming a common temperature for all components, a first main aim is the derivation of a closed system of partial mass and partial momentum balances plus a common balance of internal energy. This is achieved by careful exploitation of the entropy principle which, in particular, requires appropriate definitions of absolute temperature and chemical potentials based on an adequate definition of thermal energy that excludes diffusive contributions. The latter is crucial in order to obtain a closure framework for the interaction forces between the different species. The interaction forces split into a thermo-mechanical and a chemical part, where the former turns out to be symmetric if binary interactions are assumed. In the non-reactive case, this leads to a system of Navier-Stokes type sub-systems, coupled by interspecies friction forces. For chemical...

  10. Quantum-coherent mixtures of causal relations

    CERN Document Server

    MacLean, Jean-Philippe W; Spekkens, Robert W; Resch, Kevin J

    2016-01-01

    Understanding the causal influences that hold among the parts of a system is critical both to explaining that system's natural behaviour and to controlling it through targeted interventions. In a quantum world, understanding causal relations is equally important, but the set of possibilities is far richer. The two basic ways in which a pair of time-ordered quantum systems may be causally related are by a cause-effect mechanism or by a common cause acting on both. Here, we show that it is possible to have a coherent mixture of these two possibilities. We realize such a nonclassical causal relation in a quantum optics experiment and derive a set of criteria for witnessing the coherence based on a quantum version of Berkson's paradox. The interplay of causality and quantum theory lies at the heart of challenging foundational puzzles, such as Bell's theorem and the search for quantum gravity, but could also provide a resource for novel quantum technologies.

  11. Quantum-coherent mixtures of causal relations

    Science.gov (United States)

    MacLean, Jean-Philippe W.; Ried, Katja; Spekkens, Robert W.; Resch, Kevin J.

    2017-01-01

    Understanding the causal influences that hold among parts of a system is critical both to explaining that system's natural behaviour and to controlling it through targeted interventions. In a quantum world, understanding causal relations is equally important, but the set of possibilities is far richer. The two basic ways in which a pair of time-ordered quantum systems may be causally related are by a cause-effect mechanism or by a common-cause acting on both. Here we show a coherent mixture of these two possibilities. We realize this nonclassical causal relation in a quantum optics experiment and derive a set of criteria for witnessing the coherence based on a quantum version of Berkson's effect, whereby two independent causes can become correlated on observation of their common effect. The interplay of causality and quantum theory lies at the heart of challenging foundational puzzles, including Bell's theorem and the search for quantum gravity. PMID:28485394

  12. Thermodynamic Analysis of Chemically Reacting Mixtures and Their Kinetics: Example of a Mixture of Three Isomers.

    Science.gov (United States)

    Pekař, Miloslav

    2016-10-18

    Thermodynamics provides consequences of and restrictions on chemically reacting mixtures, particularly their kinetics, which have not been fully explored. Herein, a comprehensive thermodynamic analysis is illustrated for a reacting mixture of three isomers. The rate equation is first derived on the basis of the results of nonequilibrium continuum thermodynamics of linear fluids, and is then subjected to the requirement of consistency with entropic inequality (the second law). This consistency test involves the correct representation of the reaction rate as a function of affinities. It is shown that entropic inequality restricts the signs or values of coefficients in the constitutive equations for reaction rates/rate constants. The use of reverse rate constants and the identification of thermodynamic and kinetic equilibrium constants are not necessary in this approach. Although the presented thermodynamic analysis works only for independent reactions, the rates of dependent reactions are not excluded from having effects on kinetics. It is shown that the rates of dependent reactions are combined from the rates of independent reactions differently than dependent reactions are combined from independent reactions. The results are compared to the classical mass-action rate equations, and new restrictions on the values of the classical rate constants are derived.

  13. Chemical thermodynamics of ultrasound speed in solutions and liquid mixtures.

    Science.gov (United States)

    Reis, João Carlos R; Santos, Angela F S; Lampreia, Isabel M S

    2010-02-01

    A comprehensive formalism is developed to treat thermodynamically speed of ultrasound data for solutions and liquid mixtures. For solutions, the apparent speed of ultrasound of a solute is introduced and proposed to take the place of empirically defined quantities. The partial speed of ultrasound of a solute is defined and related to the partial molar volume and partial molar isentropic compression. For liquid mixtures, the concept of speed of sound before mixing pure liquids is presented and used to define the change in speed of ultrasound upon ideal mixing, which is predicted to be generally a negative quantity. A new thermodynamic equation is derived linking the values for excess speed of ultrasound, excess molar volume and excess molar isentropic compression of a mixture, and its applications are discussed. Ideal and excess apparent speeds of ultrasound, as well as ideal and excess partial speeds of ultrasound, are defined for substances making up a liquid mixture. Accurate speeds of ultrasound in 31 mixtures of water with the amphiphile 2-(ethylamino)ethanol at 293.15 K are reported. These data are used to demonstrate the ability of the apparent speed of ultrasound to describe the impact of solutes on sonic properties of solutions and the advantages of analysing thermodynamic properties of binary liquid mixtures in terms of the dependence on composition of Balankina's ratios between excess and ideal values. It is concluded that the new thermodynamic functions defined for speeds of ultrasound in solutions and liquid mixtures give, at the least, equivalent information on molecular aspects to the usual functions related to the isentropic compressibility, without needing density data for this purpose.

  14. Local fluctuations in solution mixtures

    Science.gov (United States)

    Ploetz, Elizabeth A.; Smith, Paul E.

    2011-01-01

    An extension of the traditional Kirkwood-Buff (KB) theory of solutions is outlined which provides additional fluctuating quantities that can be used to characterize and probe the behavior of solution mixtures. Particle-energy and energy-energy fluctuations for local regions of any multicomponent solution are expressed in terms of experimentally obtainable quantities, thereby supplementing the usual particle-particle fluctuations provided by the established KB inversion approach. The expressions are then used to analyze experimental data for pure water over a range of temperatures and pressures, a variety of pure liquids, and three binary solution mixtures – methanol and water, benzene and methanol, and aqueous sodium chloride. In addition to providing information on local properties of solutions it is argued that the particle-energy and energy-energy fluctuations can also be used to test and refine solute and solvent force fields for use in computer simulation studies. PMID:21806137

  15. Binary mixtures of chiral gases

    CERN Document Server

    Presilla, Carlo

    2015-01-01

    A possible solution of the well known paradox of chiral molecules is based on the idea of spontaneous symmetry breaking. At low pressure the molecules are delocalized between the two minima of a given molecular potential while at higher pressure they become localized in one minimum due to the intermolecular dipole-dipole interactions. Evidence for such a phase transition is provided by measurements of the inversion spectrum of ammonia and deuterated ammonia at different pressures. In particular, at pressure greater than a critical value no inversion line is observed. These data are well accounted for by a model previously developed and recently extended to mixtures. In the present paper, we discuss the variation of the critical pressure in binary mixtures as a function of the fractions of the constituents.

  16. Atomistic Simulations of Bicelle Mixtures

    OpenAIRE

    Jiang, Yong; Wang, Hao; Kindt, James T.

    2010-01-01

    Mixtures of long- and short-tail phosphatidylcholine lipids are known to self-assemble into a variety of aggregates combining flat bilayerlike and curved micellelike features, commonly called bicelles. Atomistic simulations of bilayer ribbons and perforated bilayers containing dimyristoylphosphatidylcholine (DMPC, di-C14 tails) and dihexanoylphosphatidylcholine (DHPC, di-C6 tails) have been carried out to investigate the partitioning of these components between flat and curved microenvironmen...

  17. Atomistic Simulations of Bicelle Mixtures

    OpenAIRE

    Jiang, Yong; WANG, HAO; Kindt, James T.

    2010-01-01

    Mixtures of long- and short-tail phosphatidylcholine lipids are known to self-assemble into a variety of aggregates combining flat bilayerlike and curved micellelike features, commonly called bicelles. Atomistic simulations of bilayer ribbons and perforated bilayers containing dimyristoylphosphatidylcholine (DMPC, di-C14 tails) and dihexanoylphosphatidylcholine (DHPC, di-C6 tails) have been carried out to investigate the partitioning of these components between flat and curved microenvironmen...

  18. A Lattice Boltzmann Model of Binary Fluid Mixture

    CERN Document Server

    Orlandini, E; Yeomans, J M; Orlandini, Enzo; Swift, Michael R.

    1995-01-01

    We introduce a lattice Boltzmann for simulating an immiscible binary fluid mixture. Our collision rules are derived from a macroscopic thermodynamic description of the fluid in a way motivated by the Cahn-Hilliard approach to non-equilibrium dynamics. This ensures that a thermodynamically consistent state is reached in equilibrium. The non-equilibrium dynamics is investigated numerically and found to agree with simple analytic predictions in both the one-phase and the two-phase region of the phase diagram.

  19. Hidden Markov Models with Factored Gaussian Mixtures Densities

    Institute of Scientific and Technical Information of China (English)

    LI Hao-zheng; LIU Zhi-qiang; ZHU Xiang-hua

    2004-01-01

    We present a factorial representation of Gaussian mixture models for observation densities in Hidden Markov Models(HMMs), which uses the factorial learning in the HMM framework. We derive the reestimation formulas for estimating the factorized parameters by the Expectation Maximization (EM) algorithm. We conduct several experiments to compare the performance of this model structure with Factorial Hidden Markov Models(FHMMs) and HMMs, some conclusions and promising empirical results are presented.

  20. 21 CFR 82.6 - Certifiable mixtures.

    Science.gov (United States)

    2010-04-01

    ... mixture is harmless and suitable for use therein; and (3) No diluent (except resins, natural gum, pectin... mixture is for external application to shell eggs, or for use in coloring a food specified in the...

  1. Synthesis of novel ionic liquids from lignin-derived compounds

    Energy Technology Data Exchange (ETDEWEB)

    Socha, Aaron; Singh, Seema; Simmons, Blake A.; Bergeron, Maxime

    2017-09-19

    Methods and compositions are provided for synthesizing ionic liquids from lignin derived compounds comprising: contacting a starting material comprising lignin with a depolymerization agent to depolymerize the lignin and form a mixture of aldehyde containing compounds; contacting the mixture of aldehyde containing compounds with an amine under conditions suitable to convert the mixture of aldehyde containing compounds to a mixture of amine containing compounds; and contacting the mixture of amine containing compounds with an acid under conditions suitable to form an ammonium salt, thereby preparing the ionic liquid.

  2. Psychophysical studies of mixtures of tastants

    NARCIS (Netherlands)

    Graaf, de C.

    1988-01-01

    The human perception of mixtures of tastante was studied with reference to three central issues, i.e., 1) the paradigma of equiratio taste substance mixtures. as an instrument to manipulate the physical composition of tastant mixtures. This paradiama also enables the construction of psychophysical

  3. Hemoglobin derivatives

    Science.gov (United States)

    ... this page: //medlineplus.gov/ency/article/003371.htm Hemoglobin derivatives To use the sharing features on this page, please enable JavaScript. Hemoglobin derivatives are altered forms of hemoglobin . Hemoglobin is ...

  4. Thermodynamic instabilities of a binary mixture of sticky hard spheres.

    Science.gov (United States)

    Fantoni, Riccardo; Gazzillo, Domenico; Giacometti, Achille

    2005-07-01

    The thermodynamic instabilities of a binary mixture of sticky hard spheres (SHS) in the modified mean spherical approximation (mMSA) and the Percus-Yevick (PY) approximation are investigated using an approach devised by Chen and Forstmann [corrected] [J. Chem. Phys. [corrected] 97, 3696 (1992)]. This scheme hinges on a diagonalization of the matrix of second functional derivatives of the grand canonical potential with respect to the particle density fluctuations. The zeroes of the smallest eigenvalue and the direction of the relative eigenvector characterize the instability uniquely. We explicitly compute three different classes of examples. For a symmetrical binary mixture, analytical calculations, both for mMSA and for PY, predict that when the strength of adhesiveness between like particles is smaller than the one between unlike particles, only a pure condensation spinodal exists; in the opposite regime, a pure demixing spinodal appears at high densities. We then compare the mMSA and PY results for a mixture where like particles interact as hard spheres (HS) and unlike particles as SHS, and for a mixture of HS in a SHS fluid. In these cases, even though the mMSA and PY spinodals are quantitatively and qualitatively very different from each other, we prove that they have the same kind of instabilities. Finally, we study the mMSA solution for five different mixtures obtained by setting the stickiness parameters equal to five different functions of the hard sphere diameters. We find that four of the five mixtures exhibit very different type of instabilities. Our results are expected to provide a further step toward a more thoughtful application of SHS models to colloidal fluids.

  5. Supercritical Water Mixture (SCWM) Experiment

    Science.gov (United States)

    Hicks, Michael C.; Hegde, Uday G.

    2012-01-01

    The subject presentation, entitled, Supercritical Water Mixture (SCWM) Experiment, was presented at the International Space Station (ISS) Increment 33/34 Science Symposium. This presentation provides an overview of an international collaboration between NASA and CNES to study the behavior of a dilute aqueous solution of Na2SO4 (5% w) at near-critical conditions. The Supercritical Water Mixture (SCWM) investigation, serves as important precursor work for subsequent Supercritical Water Oxidation (SCWO) experiments. The SCWM investigation will be performed in DECLICs High Temperature Insert (HTI) for the purpose of studying critical fluid phenomena at high temperatures and pressures. The HTI includes a completely sealed and integrated test cell (i.e., Sample Cell Unit SCU) that will contain approximately 0.3 ml of the aqueous test solution. During the sequence of tests, scheduled to be performed in FY13, temperatures and pressures will be elevated to critical conditions (i.e., Tc = 374C and Pc = 22 MPa) in order to observe salt precipitation, precipitate agglomeration and precipitate transport in the presence of a temperature gradient without the influences of gravitational forces. This presentation provides an overview of the motivation for this work, a description of the DECLIC HTI hardware, the proposed test sequences, and a brief discussion of the scientific research objectives.

  6. Atomistic simulations of bicelle mixtures.

    Science.gov (United States)

    Jiang, Yong; Wang, Hao; Kindt, James T

    2010-06-16

    Mixtures of long- and short-tail phosphatidylcholine lipids are known to self-assemble into a variety of aggregates combining flat bilayerlike and curved micellelike features, commonly called bicelles. Atomistic simulations of bilayer ribbons and perforated bilayers containing dimyristoylphosphatidylcholine (DMPC, di-C(14) tails) and dihexanoylphosphatidylcholine (DHPC, di-C(6) tails) have been carried out to investigate the partitioning of these components between flat and curved microenvironments and the stabilization of the bilayer edge by DHPC. To approach equilibrium partitioning of lipids on an achievable simulation timescale, configuration-bias Monte Carlo mutation moves were used to allow individual lipids to change tail length within a semigrand-canonical ensemble. Since acceptance probabilities for direct transitions between DMPC and DHPC were negligible, a third component with intermediate tail length (didecanoylphosphatidylcholine, di-C(10) tails) was included at a low concentration to serve as an intermediate for transitions between DMPC and DHPC. Strong enrichment of DHPC is seen at ribbon and pore edges, with an excess linear density of approximately 3 nm(-1). The simulation model yields estimates for the onset of edge stability with increasing bilayer DHPC content between 5% and 15% DHPC at 300 K and between 7% and 17% DHPC at 323 K, higher than experimental estimates. Local structure and composition at points of close contact between pores suggest a possible mechanism for effective attractions between pores, providing a rationalization for the tendency of bicelle mixtures to aggregate into perforated vesicles and perforated sheets.

  7. The Kinetics of Enzyme Mixtures

    Directory of Open Access Journals (Sweden)

    Simon Brown

    2014-03-01

    Full Text Available Even purified enzyme preparations are often heterogeneous. For example, preparations of aspartate aminotransferase or cytochrome oxidase can consist of several different forms of the enzyme. For this reason we consider how different the kinetics of the reactions catalysed by a mixture of forms of an enzyme must be to provide some indication of the characteristics of the species present. Based on the standard Michaelis-Menten model, we show that if the Michaelis constants (Km of two isoforms differ by a factor of at least 20 the steady-state kinetics can be used to characterise the mixture. However, even if heterogeneity is reflected in the kinetic data, the proportions of the different forms of the enzyme cannot be estimated from the kinetic data alone. Consequently, the heterogeneity of enzyme preparations is rarely reflected in measurements of their steady-state kinetics unless the species present have significantly different kinetic properties. This has two implications: (1 it is difficult, but not impossible, to detect molecular heterogeneity using kinetic data and (2 even when it is possible, a considerable quantity of high quality data is required.

  8. Effect of Mixture Pressure and Equivalence Ratio on Detonation Cell Size for Hydrogen-Air Mixtures

    Science.gov (United States)

    2015-06-01

    EFFECT OF MIXTURE PRESSURE AND EQUIVALENCE RATIO ON DETONATION CELL SIZE FOR HYDROGEN -AIR MIXTURES...protection in the United States. AFIT-ENY-MS-15-J-045 EFFECT OF MIXTURE PRESSURE AND EQUIVALENCE RATIO ON DETONATION CELL SIZE FOR HYDROGEN -AIR...DISTRIBUTION UNLIMITED. AFIT-ENY-MS-15-J-045 EFFECT OF MIXTURE PRESSURE AND EQUIVALENCE RATIO ON DETONATION CELL SIZE FOR HYDROGEN -AIR MIXTURES

  9. Proteomics based compositional analysis of complex cellulase-hemicellulase mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Chundawat, Shishir P.; Lipton, Mary S.; Purvine, Samuel O.; Uppugundla, Nirmal; Gao, Dahai; Balan, Venkatesh; Dale, Bruce E.

    2011-10-07

    Efficient deconstruction of cellulosic biomass to fermentable sugars for fuel and chemical production is accomplished by a complex mixture of cellulases, hemicellulases and accessory enzymes (e.g., >50 extracellular proteins). Cellulolytic enzyme mixtures, produced industrially mostly using fungi like Trichoderma reesei, are poorly characterized in terms of their protein composition and its correlation to hydrolytic activity on cellulosic biomass. The secretomes of commercial glycosyl hydrolase producing microbes was explored using a proteomics approach with high-throughput quantification using liquid chromatography-tandem mass spectrometry (LC-MS/MS). Here, we show that proteomics based spectral counting approach is a reasonably accurate and rapid analytical technique that can be used to determine protein composition of complex glycosyl hydrolase mixtures that also correlates with the specific activity of individual enzymes present within the mixture. For example, a strong linear correlation was seen between Avicelase activity and total cellobiohydrolase content. Reliable, quantitative and cheaper analytical methods that provide insight into the cellulosic biomass degrading fungal and bacterial secretomes would lead to further improvements towards commercialization of plant biomass derived fuels and chemicals.

  10. Identifying contributors of DNA mixtures by means of quantitative information of STR typing

    DEFF Research Database (Denmark)

    Tvedebrink, Torben; Eriksen, Poul Svante; Mogensen, Helle Smidt

    2012-01-01

    identified using polymorphic genetic markers. However, modern typing techniques supply additional quantitative data, which contain very important information about the observed evidence. This is particularly true for cases of DNA mixtures, where more than one individual has contributed to the observed...... biological stain. This article presents a method for including the quantitative information of short tandem repeat (STR) DNA mixtures in the LR. Also, an efficient algorithmic method for finding the best matching combination of DNA mixture profiles is derived and implemented in an on-line tool for two......- and three-person DNA mixtures. Finally, we demonstrate for two-person mixtures how this best matching pair of profiles can be used in estimating the likelihood ratio using importance sampling. The reason for using importance sampling for estimating the likelihood ratio is the often vast number...

  11. System applications CRC -Biomass + Coal; Aplicaciones Sistema CRC-Biomasa+Carbon

    Energy Technology Data Exchange (ETDEWEB)

    NONE

    2000-07-01

    Main object of Phase I of the project is to analyse the technical-economic feasibility of the combined use of biomass and coal for power generation in the Spanish region of Andalusia, by means of new medium-size independent power plants or using biomass as supplementary fuel in existing large coal power plants, including: -Analysis and classification of biomass and coal resources in the region -Technical-economic study of conventional alternatives using the steam cycle -Analysis of efficiency improvement provided by advanced Rankine-cycle technologies, like the SMR cycle -Analysis of alternatives based on parallel combined cycles using gas turbines, including advanced solutions, like the EAPI and CRC-EAPI systems. -Description and evaluation of different biomass drying systems. -Description and evaluation of the three main biomass gasification systems currently under development: atmospheric direct, atmospheric indirect and pressurized. Main objects of Phase II of the project are to analyse a specific application of the EAPI system to a real cogeneration plant project and to analyse the application of the CRC2 system to a commercial supercritical power plant, including technical-economic study of both applications. (Author)

  12. Synergistic evaluation of the biomass/coal blends for co-gasification purposes

    Directory of Open Access Journals (Sweden)

    S Gaqa, S Mamphweli, D Katwire, E Meyer

    2014-01-01

    Full Text Available Approximately 95% of electricity in South Africa is generated from coal, which is a fossil fuel that has detrimental environmental impacts. Eskom has started investigating the possibility of co-firing coal with biomass to improve their carbon footprint. However, co-firing utilizes approximately 80% of water and results in extensive environmental impacts. This research seeks to investigate the possibility of co-gasification of coal and biomass, which is a thermochemical process that uses about a third of the water required by a coal-fired power station, and results in much lower emissions. Thermogravimetric analysis (TGA was conducted to investigate the existence of a synergy between coal and biomass during gasification. Various coal/biomass blends were investigated using TGA. The synergistic effect between the two feedstock as determined through TGA allowed the prediction of the gasification characteristics of the blends that most likely gave the highest conversion efficiency. Preliminary results suggested the existence of this synergy.

  13. Safety-technical characteristics of biomass, coal and straw. Final report

    Energy Technology Data Exchange (ETDEWEB)

    Wilen, C.; Rautalin, A.

    1995-12-31

    Safety-technical factors related to spontaneous ignition and dust explosions of biomasses were investigated. Parametres of dust explosions and effect of inertisation on the maximum pressure (pmax) and the maximum rate of pressure rise (Kstmax) were studied at elevated initial pressure (1-9 bar). The level of inertisation required to prevent dust explosions totally was determined at different initial pressures. The sensitivity of fuels to spontaneous ignition and the effect of pressure on the sensitivity to and temperature of spontaneous ignition were studied on a pressurised dynamic self-ignition equipment. The effect of inertisation on the self-ignition temperature and alternatives of preventing spontaneous ignition by effective inertisation in the pressure ranges of 1 and 25 bar were investigated. As an example of application, results obtained with the laboratory test equipment were extrapolated to bin sizes used in practice. As a factor contributing to spontaneous ignition, the flowability of different fuels in bins and lock-hoppers (stagnant fuel layers are especially sensitive to spontaneous ignition) in continuous flow and in flow stopped for a storage time of 1 hour was also studied. Walker`s rotating ring shear equipment and Jenike`s linear shear equipment based on shearing the fuel were used in the flowability measurements. The effect of fuel temperature (22 deg C, 40 deg C) on flowability was determined for forest residue chips. Dynamic friction coefficients between fuels and handling equipment were determined for stainless steel and rusty metal surface. As an example of application, results obtained with laboratory test equipment were extrapolated to a bin size of 21 m{sup 3} by calculating the size of the minimum discharge opening required by mass flow of different coals and forest residue chips and the minimum angle of repose of the conical part for a bin of stainless steel

  14. Use of Linear Spectral Mixture Model to Estimate Rice Planted Area Based on MODIS Data

    OpenAIRE

    Lei Wang; Satoshi Uchida

    2008-01-01

    MODIS (Moderate Resolution Imaging Spectroradiometer) is a key instrument aboard the Terra (EOS AM) and Aqua (EOS PM) satellites. Linear spectral mixture models are applied to MOIDS data for the sub-pixel classification of land covers. Shaoxing county of Zhejiang Province in China was chosen to be the study site and early rice was selected as the study crop. The derived proportions of land covers from MODIS pixel using linear spectral mixture models were compared with unsupervised classificat...

  15. Measurement of the figure of merit M for 1-C3F6/SF6 mixtures

    DEFF Research Database (Denmark)

    Christensen, Jørn Erik Berril; McAllister, Iain Wilson

    1997-01-01

    High precision measurements of the linear part of the Paschen curve are reported for 1-C3F6/SF6 mixtures. From these measurements, values for the pressure-reduced limiting electric field strength (E/p)lim and the associated figure of merit M are derived. These two parameters can be used...... to characterise the insulating properties of a strongly electronegative gas or gas mixture. The present measurements confirm the existence of positive synergism....

  16. Characteristics of The Fillers Used for Realizing the Asphalt Mixtures in Romania

    Directory of Open Access Journals (Sweden)

    Irina-Mihaela Dămiean

    2005-01-01

    Full Text Available This paper presents the lab results for four types of filler used in producing the asphalt mixture in Romania, as well as other physical-chemical characteristics of a new type of filler, derivate of the grinding of the bituminous shists through a ball mill/crusher. Knowing these physical-chemical characteristics is crucial for asphalt mixtures due to the complex purpose of the filler.

  17. Financial Derivatives

    DEFF Research Database (Denmark)

    Wigan, Duncan

    2013-01-01

    Contemporary derivatives mark the development of capital and constitute a novel form of ownership. By reconfiguring the temporal, spatial and legal character of ownership derivatives present a substantive challenge to the tax collecting state. While fiscal systems are nationally bounded and inheren...... and inherently static, capital itself is unprecedentedly mobile, fluid and fungible. As such derivatives raise the specter of ‘financial weapons of mass destruction’....

  18. th-Nearest neighbour distribution functions of a binary fluid mixture

    Indian Academy of Sciences (India)

    P Sur; B Bhattacharjee

    2009-09-01

    For obtaining microscopic structural information in binary mixtures, often partial pair correlation functions are used. In the present study, a general approach is presented for obtaining the neighbourhood structural information for binary mixtures in terms of nth nearest neighbour distribution (NND) functions (for = 1, 2, 3, ...$\\ldots$). These functions are derived from the partial pair correlation functions in a hierarchical manner, based on the approach adopted earlier by us for single component fluids. Comparison of the results with MD simulation for Lennard-Jones binary mixtures is also presented. NND functions show reasonable matching for smaller n values particularly at higher density. The average th nearest neighbour distance shows interesting feature.

  19. Thermodiffusion in Multicomponent Mixtures Thermodynamic, Algebraic, and Neuro-Computing Models

    CERN Document Server

    Srinivasan, Seshasai

    2013-01-01

    Thermodiffusion in Multicomponent Mixtures presents the computational approaches that are employed in the study of thermodiffusion in various types of mixtures, namely, hydrocarbons, polymers, water-alcohol, molten metals, and so forth. We present a detailed formalism of these methods that are based on non-equilibrium thermodynamics or algebraic correlations or principles of the artificial neural network. The book will serve as single complete reference to understand the theoretical derivations of thermodiffusion models and its application to different types of multi-component mixtures. An exhaustive discussion of these is used to give a complete perspective of the principles and the key factors that govern the thermodiffusion process.

  20. On the nonequilibrium segregation state of a two-phase mixture in a porous column

    DEFF Research Database (Denmark)

    Shapiro, Alexander; Stenby, Erling Halfdan

    1996-01-01

    The problem of segregation of a two-phase multicomponent mixture under the action of thermal gradient, gravity and capillary forces is studied with respect to component distribution in a thick oil-gas-condensate reservoir. Governing equations are derived on the basis of nonequilibrium thermodynam...... thermodynamics. A steady state of the two-phase mixture with nonzero diffusion fluxes and exchange between phases is described. In the case of binary mixtures analytical formulae for saturation, component distribution and flow in the two-phase zone are obtained....

  1. Afrikaner spirituality: A complex mixture

    Directory of Open Access Journals (Sweden)

    Erna Olivier

    2006-10-01

    Full Text Available The article argues that the perception that Afrikaner spirituality is and has always been founded mainly or only upon the Calvinistic tradition is a misconception. Nineteenth century Afrikaner spiritualism consisted of a mixture of theology, philosophy and a way of adapting to extreme living conditions. These factors, although with different contents, are also the determinant issues that made 21st century Afrikaner spirituality such a complex phenomenon. The article postulates that the Afrikaner nation’s current identity crisis can be resolved by closely looking at the different influences on the spirituality of the nation and by carefully guiding the people through the complex set of multiple choices to a fresh relation with Christ in a new found Christian identity to confirm our Christian foundation.

  2. Alternative fundamental measure theory for additive hard sphere mixtures.

    Science.gov (United States)

    Malijevský, Alexandr

    2006-11-21

    The purpose of this short paper is to present an alternative fundamental measure theory (FMT) for hard sphere mixtures. Keeping the main features of the original Rosenfeld's FMT [Phys. Rev. Lett. 63, 980 (1989)] and using the dimensional and the low-density limit conditions a new functional is derived incorporating Boublik's multicomponent extension [Mol. Phys. 59, 371 (1986)] of highly accurate Kolafa's equation of state for pure hard spheres. We test the theory for pure hard spheres and hard sphere mixtures near a planar hard wall and compare the results with the original Rosenfeld's FMT and one of its modifications and with new very accurate simulation data. The test reveals an excellent agreement between the results based on the alternative FMT and simulation data for density profile near a contact and some improvement over the original Rosenfeld's FMT and its modification at the contact region.

  3. Bayesian mixture models for spectral density estimation

    OpenAIRE

    Cadonna, Annalisa

    2017-01-01

    We introduce a novel Bayesian modeling approach to spectral density estimation for multiple time series. Considering first the case of non-stationary timeseries, the log-periodogram of each series is modeled as a mixture of Gaussiandistributions with frequency-dependent weights and mean functions. The implied model for the log-spectral density is a mixture of linear mean functionswith frequency-dependent weights. The mixture weights are built throughsuccessive differences of a logit-normal di...

  4. Thermodynamic Calculations for Complex Chemical Mixtures

    Science.gov (United States)

    Mcbride, B. J.

    1986-01-01

    General computer program, CECTRP, developed for calculation of thermodynamic properties of complex mixtures with option to calculate transport properties of these mixtures. Free-energy minimization technique used in equilibrium calculation. Rigorous equations used in transport calculations. Program calculates equilibrium compositions and corresponding thermodynamic and transport properties of mixtures. CECTRP accommodates up to 24 reactants, 20 elements, and 600 products, 400 of which are condensed. Written in FORTRAN IV for any large computer system.

  5. Financial Derivatives

    DEFF Research Database (Denmark)

    Wigan, Duncan

    2013-01-01

    Contemporary derivatives mark the development of capital and constitute a novel form of ownership. By reconfiguring the temporal, spatial and legal character of ownership derivatives present a substantive challenge to the tax collecting state. While fiscal systems are nationally bounded...

  6. Exclusion probabilities and likelihood ratios with applications to mixtures.

    Science.gov (United States)

    Slooten, Klaas-Jan; Egeland, Thore

    2016-01-01

    The statistical evidence obtained from mixed DNA profiles can be summarised in several ways in forensic casework including the likelihood ratio (LR) and the Random Man Not Excluded (RMNE) probability. The literature has seen a discussion of the advantages and disadvantages of likelihood ratios and exclusion probabilities, and part of our aim is to bring some clarification to this debate. In a previous paper, we proved that there is a general mathematical relationship between these statistics: RMNE can be expressed as a certain average of the LR, implying that the expected value of the LR, when applied to an actual contributor to the mixture, is at least equal to the inverse of the RMNE. While the mentioned paper presented applications for kinship problems, the current paper demonstrates the relevance for mixture cases, and for this purpose, we prove some new general properties. We also demonstrate how to use the distribution of the likelihood ratio for donors of a mixture, to obtain estimates for exceedance probabilities of the LR for non-donors, of which the RMNE is a special case corresponding to L R>0. In order to derive these results, we need to view the likelihood ratio as a random variable. In this paper, we describe how such a randomization can be achieved. The RMNE is usually invoked only for mixtures without dropout. In mixtures, artefacts like dropout and drop-in are commonly encountered and we address this situation too, illustrating our results with a basic but widely implemented model, a so-called binary model. The precise definitions, modelling and interpretation of the required concepts of dropout and drop-in are not entirely obvious, and we attempt to clarify them here in a general likelihood framework for a binary model.

  7. Empirical profile mixture models for phylogenetic reconstruction

    National Research Council Canada - National Science Library

    Si Quang, Le; Gascuel, Olivier; Lartillot, Nicolas

    2008-01-01

    Motivation: Previous studies have shown that accounting for site-specific amino acid replacement patterns using mixtures of stationary probability profiles offers a promising approach for improving...

  8. Simulation of mixture microstructures via particle packing models and their direct comparison with real mixtures

    Science.gov (United States)

    Gulliver, Eric A.

    The objective of this thesis to identify and develop techniques providing direct comparison between simulated and real packed particle mixture microstructures containing submicron-sized particles. This entailed devising techniques for simulating powder mixtures, producing real mixtures with known powder characteristics, sectioning real mixtures, interrogating mixture cross-sections, evaluating and quantifying the mixture interrogation process and for comparing interrogation results between mixtures. A drop and roll-type particle-packing model was used to generate simulations of random mixtures. The simulated mixtures were then evaluated to establish that they were not segregated and free from gross defects. A powder processing protocol was established to provide real mixtures for direct comparison and for use in evaluating the simulation. The powder processing protocol was designed to minimize differences between measured particle size distributions and the particle size distributions in the mixture. A sectioning technique was developed that was capable of producing distortion free cross-sections of fine scale particulate mixtures. Tessellation analysis was used to interrogate mixture cross sections and statistical quality control charts were used to evaluate different types of tessellation analysis and to establish the importance of differences between simulated and real mixtures. The particle-packing program generated crescent shaped pores below large particles but realistic looking mixture microstructures otherwise. Focused ion beam milling was the only technique capable of sectioning particle compacts in a manner suitable for stereological analysis. Johnson-Mehl and Voronoi tessellation of the same cross-sections produced tessellation tiles with different the-area populations. Control charts analysis showed Johnson-Mehl tessellation measurements are superior to Voronoi tessellation measurements for detecting variations in mixture microstructure, such as altered

  9. Thermodynamics of mixtures containing amines

    Energy Technology Data Exchange (ETDEWEB)

    Gonzalez, Juan Antonio [G.E.T.E.F. Dpto Termodinamica y Fisica Aplicada, Facultad de Ciencias, Universidad de Valladolid, Valladolid 47071 (Spain)], E-mail: jagl@termo.uva.es; Mozo, Ismael; Garcia de la Fuente, Isaias; Cobos, Jose Carlos [G.E.T.E.F. Dpto Termodinamica y Fisica Aplicada, Facultad de Ciencias, Universidad de Valladolid, Valladolid 47071 (Spain); Riesco, Nicolas [Department of Chemical Engineering, Loughborough University, Loughborough, LE113TU Leicestershire (United Kingdom)

    2008-01-30

    Mixtures with dimethyl or trimethylpyridines and alkane, aromatic compound or 1-alkanol have been examined using different theories: DISQUAC, Flory, the concentration-concentration structure factor, S{sub CC}(0), or the Kirkwood-Buff formalism. DISQUAC represents fairly well the available experimental data, and improves theoretical calculations from Dortmund UNIFAC. Two important effects have been investigated: (i) the effect of increasing the number of methyl groups attached to the aromatic ring of the amine; (ii) the effect of modifying the position of the methyl groups in this ring. The molar excess enthalpy, H{sup E}, and the molar excess volume, V{sup E}, decrease in systems with alkane or methanol as follows: pyridine > 3-methylpyridine > 3,5-dimethylpyridine and pyridine > 2-methylpyridine > 2,4-dimethylpyridine > 2,4,6-trimethylpyridine, which has been attributed to a weakening of the amine-amine interactions in the same sequences. This is in agreement with the relative variation of the effective dipole moment, {mu}-bar, and of the differences between the boiling temperature of a pyridine base and that of the homomorphic alkane. For heptane solutions, the observed H{sup E} variation, H{sup E} (3,5-dimethylpyridine) > H{sup E} (2,4-dimethylpyridine) > H{sup E} (2,6-dimethylpyridine), is explained similarly. Calculations on the basis of the Flory model confirm that orientational effects become weaker in systems with alkane in the order: pyridine > methylpyridine > dimethylpyridine > trimethylpyridine. S{sub CC}(0) calculations show that steric effects increase with the number of CH{sub 3}- groups in the pyridine base, and that the steric effects exerted by methyl groups in positions 2 and 6 are higher than when they are placed in positions 3 and 5. The hydrogen bond energy in methanol mixtures is independent of the pyridine base, and it is estimated to be -35.2 kJ mol{sup -1}. Heterocoordination in these solutions is due in part to size effects. Their

  10. Time-dependence in mixture toxicity prediction.

    Science.gov (United States)

    Dawson, Douglas A; Allen, Erin M G; Allen, Joshua L; Baumann, Hannah J; Bensinger, Heather M; Genco, Nicole; Guinn, Daphne; Hull, Michael W; Il'Giovine, Zachary J; Kaminski, Chelsea M; Peyton, Jennifer R; Schultz, T Wayne; Pöch, Gerald

    2014-12-04

    The value of time-dependent toxicity (TDT) data in predicting mixture toxicity was examined. Single chemical (A and B) and mixture (A+B) toxicity tests using Microtox(®) were conducted with inhibition of bioluminescence (Vibrio fischeri) being quantified after 15, 30 and 45-min of exposure. Single chemical and mixture tests for 25 sham (A1:A2) and 125 true (A:B) combinations had a minimum of seven duplicated concentrations with a duplicated control treatment for each test. Concentration/response (x/y) data were fitted to sigmoid curves using the five-parameter logistic minus one parameter (5PL-1P) function, from which slope, EC25, EC50, EC75, asymmetry, maximum effect, and r(2) values were obtained for each chemical and mixture at each exposure duration. Toxicity data were used to calculate percentage-based TDT values for each individual chemical and mixture of each combination. Predicted TDT values for each mixture were calculated by averaging the TDT values of the individual components and regressed against the observed TDT values obtained in testing, resulting in strong correlations for both sham (r(2)=0.989, n=25) and true mixtures (r(2)=0.944, n=125). Additionally, regression analyses confirmed that observed mixture TDT values calculated for the 50% effect level were somewhat better correlated with predicted mixture TDT values than at the 25 and 75% effect levels. Single chemical and mixture TDT values were classified into five levels in order to discern trends. The results suggested that the ability to predict mixture TDT by averaging the TDT of the single agents was modestly reduced when one agent of the combination had a positive TDT value and the other had a minimal or negative TDT value. Copyright © 2014 Elsevier Ireland Ltd. All rights reserved.

  11. A Variational approach to thin film hydrodynamics of binary mixtures

    KAUST Repository

    Xu, Xinpeng

    2015-02-04

    In order to model the dynamics of thin films of mixtures, solutions, and suspensions, a thermodynamically consistent formulation is needed such that various coexisting dissipative processes with cross couplings can be correctly described in the presence of capillarity, wettability, and mixing effects. In the present work, we apply Onsager\\'s variational principle to the formulation of thin film hydrodynamics for binary fluid mixtures. We first derive the dynamic equations in two spatial dimensions, one along the substrate and the other normal to the substrate. Then, using long-wave asymptotics, we derive the thin film equations in one spatial dimension along the substrate. This enables us to establish the connection between the present variational approach and the gradient dynamics formulation for thin films. It is shown that for the mobility matrix in the gradient dynamics description, Onsager\\'s reciprocal symmetry is automatically preserved by the variational derivation. Furthermore, using local hydrodynamic variables, our variational approach is capable of introducing diffusive dissipation beyond the limit of dilute solute. Supplemented with a Flory-Huggins-type mixing free energy, our variational approach leads to a thin film model that treats solvent and solute in a symmetric manner. Our approach can be further generalized to include more complicated free energy and additional dissipative processes.

  12. Bicyclic glutamic acid derivatives.

    Science.gov (United States)

    Meyer, Udo; Bisel, Philippe; Weckert, Edgar; Frahm, August Wilhelm

    2006-05-15

    For the second-generation asymmetric synthesis of the trans-tris(homoglutamic) acids via Strecker reaction of chiral ketimines, the cyanide addition as the key stereodifferentiating step produces mixtures of diastereomeric alpha-amino nitrile esters the composition of which is independent of the reaction temperature and the type of the solvent, respectively. The subsequent hydrolysis is exclusively achieved with concentrated H(2)SO(4) yielding diastereomeric mixtures of three secondary alpha-amino alpha-carbamoyl-gamma-esters and two diastereomeric cis-fused angular alpha-carbamoyl gamma-lactams as bicyclic glutamic acid derivatives, gained from in situ stereomer differentiating cyclisation of the secondary cis-alpha-amino alpha-carbamoyl-gamma-esters. Separation was achieved by CC. The pure secondary trans-alpha-amino alpha-carbamoyl-gamma-esters cyclise on heating and treatment with concentrated H(2)SO(4), respectively, to diastereomeric cis-fused angular secondary alpha-amino imides. Their hydrogenolysis led to the enantiomeric cis-fused angular primary alpha-amino imides. The configuration of all compounds was completely established by NMR methods, CD-spectra, and by X-ray analyses of the (alphaR,1R,5R)-1-carbamoyl-2-(1-phenylethyl)-2-azabicyclo[3.3.0]octan-3-one and of the trans-alphaS,1S,2R-2-ethoxycarbonylmethyl-1-(1-phenylethylamino)cyclopentanecarboxamide.

  13. Derivative Chameleons

    CERN Document Server

    Noller, Johannes

    2012-01-01

    We consider generalized chameleon models where the conformal coupling between matter and gravitational geometries is not only a function of the chameleon field \\phi, but also of its derivatives via higher order co-ordinate invariants. Specifically we consider the first such non-trivial conformal factor A(\\phi,X), where X is the canonical kinetic term for \\phi. The associated phenomenology is investigated and we show that such theories have a new generic mass-altering mechanism, potentially assisting the generation of a sufficiently large chameleon mass in dense environments. The most general effective potential is derived for such derivative chameleon setups and explicit examples are given. Interestingly this points us to the existence of a purely derivative chameleon protected by a shift symmetry for \\phi. We also discuss potential ghost-like instabilities associated with mass-lifting mechanisms and find another, mass-lowering and instability-free, branch of solutions. This suggests that, barring fine-tuning...

  14. A proposed experimental platform for measuring the properties of warm dense mixtures: Testing the applicability of the linear mixing model

    Science.gov (United States)

    Hawreliak, James

    2017-06-01

    This paper presents a proposed experimental technique for investigating the impact of chemical interactions in warm dense liquid mixtures. It uses experimental equation of state (EOS) measurements of warm dense liquid mixtures with different compositions to determine the deviation from the linear mixing model. Statistical mechanics is used to derive the EOS of a mixture with a constant pressure linear mixing term (Amagat's rule) and an interspecies interaction term. A ratio between the particle density of two different compositions of mixtures, K(P, T)i: ii, is defined. By comparing this ratio for a range of mixtures, the impact of interspecies interactions can be studied. Hydrodynamic simulations of mixtures with different carbon/hydrogen ratios are used to demonstrate the application of this proposed technique to multiple shock and ramp compression experiments. The limit of the pressure correction that can be measured due to interspecies interactions using this methodology is determined by the uncertainty in the density measurement.

  15. Mixture Modeling: Applications in Educational Psychology

    Science.gov (United States)

    Harring, Jeffrey R.; Hodis, Flaviu A.

    2016-01-01

    Model-based clustering methods, commonly referred to as finite mixture modeling, have been applied to a wide variety of cross-sectional and longitudinal data to account for heterogeneity in population characteristics. In this article, we elucidate 2 such approaches: growth mixture modeling and latent profile analysis. Both techniques are…

  16. Two-microphone Separation of Speech Mixtures

    DEFF Research Database (Denmark)

    2006-01-01

    Matlab source code for underdetermined separation of instaneous speech mixtures. The algorithm is described in [1] Michael Syskind Pedersen, DeLiang Wang, Jan Larsen and Ulrik Kjems: ''Two-microphone Separation of Speech Mixtures,'' 2006, submitted for journal publoication. See also, [2] Michael...

  17. Fibril assembly in whey protein mixtures

    NARCIS (Netherlands)

    Bolder, S.G.

    2007-01-01

    The objective of this thesis was to study fibril assembly in mixtures of whey proteins. The effect of the composition of the protein mixture on the structures and the resulting phase behaviour was investigated. The current work has shown that beta-lactoglobulin is responsible for the fibril assembly

  18. Soret motion in non-ionic binary molecular mixtures.

    Science.gov (United States)

    Leroyer, Yves; Würger, Alois

    2011-08-07

    We study the Soret coefficient of binary molecular mixtures with dispersion forces. Relying on standard transport theory for liquids, we derive explicit expressions for the thermophoretic mobility and the Soret coefficient. Their sign depends on composition, the size ratio of the two species, and the ratio of Hamaker constants. Our results account for several features observed in experiment, such as a linear variation with the composition; they confirm the general rule that small molecules migrate to the warm, and large ones to the cold.

  19. Minimum Mean Square Error Estimation Under Gaussian Mixture Statistics

    CERN Document Server

    Flam, John T; Kansanen, Kimmo; Ekman, Torbjorn

    2011-01-01

    This paper investigates the minimum mean square error (MMSE) estimation of x, given the observation y = Hx+n, when x and n are independent and Gaussian Mixture (GM) distributed. The introduction of GM distributions, represents a generalization of the more familiar and simpler Gaussian signal and Gaussian noise instance. We present the necessary theoretical foundation and derive the MMSE estimator for x in a closed form. Furthermore, we provide upper and lower bounds for its mean square error (MSE). These bounds are validated through Monte Carlo simulations.

  20. Supercritical separation process for complex organic mixtures

    Science.gov (United States)

    Chum, Helena L.; Filardo, Giuseppe

    1990-01-01

    A process is disclosed for separating low molecular weight components from complex aqueous organic mixtures. The process includes preparing a separation solution of supercritical carbon dioxide with an effective amount of an entrainer to modify the solvation power of the supercritical carbon dioxide and extract preselected low molecular weight components. The separation solution is maintained at a temperature of at least about 70.degree. C. and a pressure of at least about 1,500 psi. The separation solution is then contacted with the organic mixtures while maintaining the temperature and pressure as above until the mixtures and solution reach equilibrium to extract the preselected low molecular weight components from the organic mixtures. Finally, the entrainer/extracted components portion of the equilibrium mixture is isolated from the separation solution.

  1. Esterification of fermentation-derived acids via pervaporation

    Science.gov (United States)

    Datta, Rathin; Tsai, Shih-Perng

    1998-01-01

    A low temperature method for esterifying ammonium- and amine-containing salts is provided whereby the salt is reacted with an alcohol in the presence of heat and a catalyst and then subjected to a dehydration and deamination process using pervaporation. The invention also provides for a method for producing esters of fermentation derived, organic acid salt comprising first cleaving the salt into its cationic part and anionic part, mixing the anionic part with an alcohol to create a mixture; heating the mixture in the presence of a catalyst to create an ester; dehydrating the now heated mixture; and separating the ester from the now-dehydrated mixture.

  2. Increased plant carbon translocation linked to overyielding in grassland species mixtures.

    Directory of Open Access Journals (Sweden)

    Gerlinde B De Deyn

    Full Text Available Plant species richness and productivity often show a positive relationship, but the underlying mechanisms are not fully understood, especially at the plant species level. We examined how growing plants in species mixture influences intraspecific rates of short-term carbon (C- translocation, and determined whether such short-term responses are reflected in biomass yields. We grew monocultures and mixtures of six common C3 grassland plant species in outdoor mesocosms, applied a (13C-CO(2 pulse in situ to trace assimilated C through plants, into the soil, and back to the atmosphere, and quantified species-specific biomass. Pulse derived (13C enrichment was highest in the legumes Lotus corniculatus and Trifolium repens, and relocation (i.e. transport from the leaves to other plant parts of the recently assimilated (13C was most rapid in T. repens grown in 6-species mixtures. The grass Anthoxanthum odoratum also showed high levels of (13C enrichment in 6-species mixtures, while (13C enrichment was low in Lolium perenne, Plantago lanceolata and Achillea millefolium. Rates of C loss through respiration were highest in monocultures of T. repens and relatively low in species mixtures, while the proportion of (13C in the respired CO(2 was similar in monocultures and mixtures. The grass A. odoratum and legume T. repens were most promoted in 6-species mixtures, and together with L. corniculatus, caused the net biomass increase in 6-species mixtures. These plant species also had highest rates of (13C-label translocation, and for A. odoratum and T. repens this effect was greatest in plant individuals grown in species mixtures. Our study reveals that short-term plant C translocation can be accelerated in plant individuals of legume and C3 grass species when grown in mixtures, and that this is strongly positively related to overyielding. These results demonstrate a mechanistic coupling between changes in intraspecific plant carbon physiology and increased

  3. Lithium solvation in dimethyl sulfoxide-acetonitrile mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Semino, Rocío; Zaldívar, Gervasio; Calvo, Ernesto J. [Departamento de Química Inorgánica Analítica y Química-Física e INQUIMAE, Facultad de Ciencias Exactas y Naturales, Universidad de Buenos Aires, Ciudad Universitaria, Pabellón II, 1428 Buenos Aires (Argentina); Laria, Daniel, E-mail: dhlaria@cnea.gov.ar [Departamento de Química Inorgánica Analítica y Química-Física e INQUIMAE, Facultad de Ciencias Exactas y Naturales, Universidad de Buenos Aires, Ciudad Universitaria, Pabellón II, 1428 Buenos Aires (Argentina); Departamento de Física de la Materia Condensada, Comisión Nacional de Energía Atómica, Avenida Libertador 8250, 1429 Buenos Aires (Argentina)

    2014-12-07

    We present molecular dynamics simulation results pertaining to the solvation of Li{sup +} in dimethyl sulfoxide-acetonitrile binary mixtures. The results are potentially relevant in the design of Li-air batteries that rely on aprotic mixtures as solvent media. To analyze effects derived from differences in ionic size and charge sign, the solvation of Li{sup +} is compared to the ones observed for infinitely diluted K{sup +} and Cl{sup −} species, in similar solutions. At all compositions, the cations are preferentially solvated by dimethyl sulfoxide. Contrasting, the first solvation shell of Cl{sup −} shows a gradual modification in its composition, which varies linearly with the global concentrations of the two solvents in the mixtures. Moreover, the energetics of the solvation, described in terms of the corresponding solute-solvent coupling, presents a clear non-ideal concentration dependence. Similar nonlinear trends were found for the stabilization of different ionic species in solution, compared to the ones exhibited by their electrically neutral counterparts. These tendencies account for the characteristics of the free energy associated to the stabilization of Li{sup +}Cl{sup −}, contact-ion-pairs in these solutions. Ionic transport is also analyzed. Dynamical results show concentration trends similar to those recently obtained from direct experimental measurements.

  4. Simulation study of water and sugar dynamics in supercooled mixtures

    Science.gov (United States)

    Molinero, Valeria; Cagin, Tahir; Goddard, William A.

    2003-03-01

    Water dynamics in concentrated carbohydrate solutions is of utmost importance in food and pharmaceutical technology, where low water mobility is desirable to slow down chemical degradation and preserve biomolecules. We have studied the microscopic mechanism of water diffusion in binary and polydisperse malto-oligosaccharides and water mixtures by means of molecular dynamics simulations. The computations were performed with a coarse grain model (M3B), derived from atomistic simulations of water and malto-oligosaccharides. The use of the M3B model permits simulations of the order of 0.1 microsecond, thus allowing us to explore water dynamics from the liquid to the deep supercooled regime. The dynamics of water confined in the sugar matrix is slowed down with respect to bulk water. We found that at low moisture content and low temperature, ranslational diffusion of water and glucose rotation proceed through a hopping-diffusion mechanism. Moreover, we found water mobility to be heterogeneous: there is a broad distribution of time scales for different water molecules in the mixtures. We discuss whether there is a relationship between the heterogeneous structure of these mixtures in the sub-nanometer scale and the heterogeneous dynamics of water molecules.

  5. Modeling, clustering, and segmenting video with mixtures of dynamic textures.

    Science.gov (United States)

    Chan, Antoni B; Vasconcelos, Nuno

    2008-05-01

    A dynamic texture is a spatio-temporal generative model for video, which represents video sequences as observations from a linear dynamical system. This work studies the mixture of dynamic textures, a statistical model for an ensemble of video sequences that is sampled from a finite collection of visual processes, each of which is a dynamic texture. An expectationmaximization (EM) algorithm is derived for learning the parameters of the model, and the model is related to previous works in linear systems, machine learning, time-series clustering, control theory, and computer vision. Through experimentation, it is shown that the mixture of dynamic textures is a suitable representation for both the appearance and dynamics of a variety of visual processes that have traditionally been challenging for computer vision (e.g. fire, steam, water, vehicle and pedestrian traffic, etc.). When compared with state-of-the-art methods in motion segmentation, including both temporal texture methods and traditional representations (e.g. optical flow or other localized motion representations), the mixture of dynamic textures achieves superior performance in the problems of clustering and segmenting video of such processes.

  6. Derivative chameleons

    Science.gov (United States)

    Noller, Johannes

    2012-07-01

    We consider generalized chameleon models where the conformal coupling between matter and gravitational geometries is not only a function of the chameleon field phi, but also of its derivatives via higher order co-ordinate invariants (such as ∂μphi∂μphi,squphi,...). Specifically we consider the first such non-trivial conformal factor A(phi,∂μphi∂μphi). The associated phenomenology is investigated and we show that such theories have a new generic mass-altering mechanism, potentially assisting the generation of a sufficiently large chameleon mass in dense environments. The most general effective potential is derived for such derivative chameleon setups and explicit examples are given. Interestingly this points us to the existence of a purely derivative chameleon protected by a shift symmetry for phi → phi+c. We also discuss potential ghost-like instabilities associated with mass-lifting mechanisms and find another, mass-lowering and instability-free, branch of solutions. This suggests that, barring fine-tuning, stable derivative models are in fact typically anti-chameleons that suppress the field's mass in dense environments. Furthermore we investigate modifications to the thin-shell regime and prove a no-go theorem for chameleon effects in non-conformal geometries of the disformal type.

  7. Approach for optimization of the color rendering index of light mixtures.

    Science.gov (United States)

    Lin, Ku Chin

    2010-07-01

    The general CIE color rendering index (CRI) of light is an important index to evaluate the quality of illumination. However, because of the complexity in measurement of the rendering ability under designated constraints, an approach for general mathematical formulation and global optimization of the rendering ability of light emitting diode (LED) light mixtures is difficult to develop. This study is mainly devoted to developing mathematical formulation and a numerical method for the CRI optimization. The method is developed based on the so-called complex method [Computer J.8, 42 (1965); G. V. Reklaitis et al., Engineering Optimization-Methods and Applications (Wiley, 1983)] with modifications. It is first applicable to 3-color light mixtures and then extended to a hierarchical and iterative structure for higher-order light mixtures. The optimization is studied under the constraints of bounded relative intensities of the light mixture, designated correlated color temperature (CCT), and the required approximate white of the light mixture. The problems of inconsistent constraints and solutions are addressed. The CRI is a complicated function of the relative intensities of the compound illuminators of the mixture. The proposed method requires taking no derivatives of the function and is very adequate for the optimization. This is demonstrated by simulation for RGBW LED light mixtures. The results show that global and unique convergence to the optimal within required tolerances for CRI and spatial dispersivity is always achieved.

  8. MIXPAC: a subroutine package for calculating equations of state for equilibrium mixtures of materials

    Energy Technology Data Exchange (ETDEWEB)

    Cranfill, C.W.

    1983-08-01

    This manual describes MIXPAC, a subroutine package for calculating equations of state (i.e., thermodynamic and transport properties) for plasmas composed of equilibrium mixtures of materials. The package is vectorized for the Los Alamos Cray-1 computers and uses EOSPAC, another vectorized subroutine package, to access the Los Alamos Sesame EOS data library. Each mixture is forced to be in equilibrium through the constraints that all its constituents have the same values for two state functions (e.g., temperature and pressure). The desired equations of state (including first partial derivatives) are then calculated for the mixture consistent with these constraints. All equations of state available for pure materials through EOSPAC are available for equilibrium mixtures through MIXPAC.

  9. Global Derivatives

    DEFF Research Database (Denmark)

    Andersen, Torben Juul

    ." - Steen Parsholt, Chairman and CEO, Aon Nordic Region. "Andersen has done a wonderful job of developing a comprehensive text that deals with risk management in global markets. I would recommend this book to any student or businessman who has a need to better understand the risks and risk management...... management practice. Of particular note is the global and integrated approach chosen in this book which should be of special interest to aspiring managers active in global and international markets." - Dr Jean-Pierre Zigrand, Lecturer in Finance, London School of Economics, UK. More than 90 per cent...... management situations. Its key features include: derivatives are introduced in a global market perspective; describes major derivative pricing models for practical use, extending these principles to valuation of real options; practical applications of derivative instruments are richly illustrated...

  10. Electricity derivatives

    CERN Document Server

    Aïd, René

    2015-01-01

    Offering a concise but complete survey of the common features of the microstructure of electricity markets, this book describes the state of the art in the different proposed electricity price models for pricing derivatives and in the numerical methods used to price and hedge the most prominent derivatives in electricity markets, namely power plants and swings. The mathematical content of the book has intentionally been made light in order to concentrate on the main subject matter, avoiding fastidious computations. Wherever possible, the models are illustrated by diagrams. The book should allow prospective researchers in the field of electricity derivatives to focus on the actual difficulties associated with the subject. It should also offer a brief but exhaustive overview of the latest techniques used by financial engineers in energy utilities and energy trading desks.

  11. Foaming of mixtures of pure hydrocarbons

    Science.gov (United States)

    Robinson, J. V.; Woods, W. W.

    1950-01-01

    Mixtures of pure liquid hydrocarbons are capable of foaming. Nine hydrocarbons were mixed in pairs, in all possible combinations, and four proportions of each combination. These mixtures were sealed in glass tubes, and the foaming was tested by shaking. Mixtures of aliphatic with other aliphatic hydrocarbons, or of alkyl benzenes with other alkyl benzenes, did not foam. Mixtures of aliphatic hydrocarbons with alkyl benzenes did foam. The proportions of the mixtures greatly affected the foaming, the maximum foaming of 12 of 20 pairs being at the composition 20 percent aliphatic hydrocarbon, 80 percent alkyl benzene. Six seconds was the maximum foam lifetime of any of these mixtures. Aeroshell 120 lubricating oil was fractionated into 52 fractions and a residue by extraction with acetone in a fractionating extractor. The index of refraction, foam lifetime, color, and viscosity of these fractions were measured. Low viscosity and high index fractions were extracted first. The viscosity of the fractions extracted rose and the index decreased as fractionation proceeded. Foam lifetimes and color were lowest in the middle fractions. Significance is attached to the observation that none of the foam lifetimes of the fractions or residue is as high as the foam lifetime of the original Aeroshell, indicating that the foaming is not due to a particular foaming constituent, but rather to the entire mixture.

  12. Coking technology using packed coal mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Kuznichenko, V.M.; Shteinberg, Eh.A.; Tolstoi, A.P. (Khar' kovskii Nauchno-Issledovatel' skii Uglekhimicheskii Institut, Kharkov (Ukrainian SSR))

    1991-08-01

    Discusses coking of packed coal charges in the FRG, USSR, France, India, Poland and Czechoslovakia. The following aspects are evaluated: types of weakly caking coals that are used as components of packed mixtures, energy consumption of packing, effects of coal mixture packing on coke oven design, number of coke ovens in a battery, heating temperature, coking time, coke properties, investment and operating cost. Statistical data that characterize the Saarberg packing process used in the FRG are analyzed. Packing coal mixtures for coking improves coke quality and reduces environmental pollution. 4 refs.

  13. Evaluation of diffusion coefficients in multicomponent mixtures by means of the fluctuation theory

    DEFF Research Database (Denmark)

    Shapiro, Alexander

    2003-01-01

    We derive general expressions for diffusion coefficients in multicomponent non-ideal gas or liquid mixtures. The derivation is based on the general statistical theory of fluctuations around an equilibrium state. The matrix of diffusion coefficients is expressed in terms of the equilibrium thermod...... characteristics. We demonstrate on several examples that the developed theory is in agreement with the established experimental facts and dependencies for the diffusion coefficients. (C) 2002 Elsevier Science B.V. All rights reserved.......We derive general expressions for diffusion coefficients in multicomponent non-ideal gas or liquid mixtures. The derivation is based on the general statistical theory of fluctuations around an equilibrium state. The matrix of diffusion coefficients is expressed in terms of the equilibrium...

  14. Dirichlet multinomial mixtures: generative models for microbial metagenomics.

    Science.gov (United States)

    Holmes, Ian; Harris, Keith; Quince, Christopher

    2012-01-01

    We introduce Dirichlet multinomial mixtures (DMM) for the probabilistic modelling of microbial metagenomics data. This data can be represented as a frequency matrix giving the number of times each taxa is observed in each sample. The samples have different size, and the matrix is sparse, as communities are diverse and skewed to rare taxa. Most methods used previously to classify or cluster samples have ignored these features. We describe each community by a vector of taxa probabilities. These vectors are generated from one of a finite number of Dirichlet mixture components each with different hyperparameters. Observed samples are generated through multinomial sampling. The mixture components cluster communities into distinct 'metacommunities', and, hence, determine envirotypes or enterotypes, groups of communities with a similar composition. The model can also deduce the impact of a treatment and be used for classification. We wrote software for the fitting of DMM models using the 'evidence framework' (http://code.google.com/p/microbedmm/). This includes the Laplace approximation of the model evidence. We applied the DMM model to human gut microbe genera frequencies from Obese and Lean twins. From the model evidence four clusters fit this data best. Two clusters were dominated by Bacteroides and were homogenous; two had a more variable community composition. We could not find a significant impact of body mass on community structure. However, Obese twins were more likely to derive from the high variance clusters. We propose that obesity is not associated with a distinct microbiota but increases the chance that an individual derives from a disturbed enterotype. This is an example of the 'Anna Karenina principle (AKP)' applied to microbial communities: disturbed states having many more configurations than undisturbed. We verify this by showing that in a study of inflammatory bowel disease (IBD) phenotypes, ileal Crohn's disease (ICD) is associated with a more variable

  15. Dirichlet multinomial mixtures: generative models for microbial metagenomics.

    Directory of Open Access Journals (Sweden)

    Ian Holmes

    Full Text Available We introduce Dirichlet multinomial mixtures (DMM for the probabilistic modelling of microbial metagenomics data. This data can be represented as a frequency matrix giving the number of times each taxa is observed in each sample. The samples have different size, and the matrix is sparse, as communities are diverse and skewed to rare taxa. Most methods used previously to classify or cluster samples have ignored these features. We describe each community by a vector of taxa probabilities. These vectors are generated from one of a finite number of Dirichlet mixture components each with different hyperparameters. Observed samples are generated through multinomial sampling. The mixture components cluster communities into distinct 'metacommunities', and, hence, determine envirotypes or enterotypes, groups of communities with a similar composition. The model can also deduce the impact of a treatment and be used for classification. We wrote software for the fitting of DMM models using the 'evidence framework' (http://code.google.com/p/microbedmm/. This includes the Laplace approximation of the model evidence. We applied the DMM model to human gut microbe genera frequencies from Obese and Lean twins. From the model evidence four clusters fit this data best. Two clusters were dominated by Bacteroides and were homogenous; two had a more variable community composition. We could not find a significant impact of body mass on community structure. However, Obese twins were more likely to derive from the high variance clusters. We propose that obesity is not associated with a distinct microbiota but increases the chance that an individual derives from a disturbed enterotype. This is an example of the 'Anna Karenina principle (AKP' applied to microbial communities: disturbed states having many more configurations than undisturbed. We verify this by showing that in a study of inflammatory bowel disease (IBD phenotypes, ileal Crohn's disease (ICD is associated with

  16. Self-consistent generalized Langevin equation for colloidal mixtures.

    Science.gov (United States)

    Chávez-Rojo, Marco Antonio; Medina-Noyola, Magdaleno

    2005-09-01

    A self-consistent theory of collective and tracer diffusion in colloidal mixtures is presented. This theory is based on exact results for the partial intermediate scattering functions derived within the framework of the generalized Langevin equation formalism, plus a number of conceptually simple and sensible approximations. The first of these consists of a Vineyard-like approximation between collective and tracer diffusion, which writes the collective dynamics in terms of the memory function related to tracer diffusion. The second consists of interpolating this only unknown memory function between its two exact limits at small and large wave vectors; for this, a phenomenologically determined, but not arbitrary, interpolating function is introduced: a Lorentzian with its inflection point located at the first minimum of the partial static structure factor. The small wave-vector exact limit involves a time-dependent friction function, for which we take a general approximate result, previously derived within the generalized Langevin equation formalism. This general result expresses the time-dependent friction function in terms of the partial intermediate scattering functions, thus closing the system of equations into a fully self-consistent scheme. This extends to mixtures a recently proposed self-consistent theory developed for monodisperse suspensions [Yeomans-Reyna and Medina-Noyola, Phys. Rev. E 64, 066114 (2001)]. As an illustration of its quantitative accuracy, its application to a simple model of a binary dispersion in the absence of hydrodynamic interactions is reported.

  17. Quantiles for Finite Mixtures of Normal Distributions

    Science.gov (United States)

    Rahman, Mezbahur; Rahman, Rumanur; Pearson, Larry M.

    2006-01-01

    Quantiles for finite mixtures of normal distributions are computed. The difference between a linear combination of independent normal random variables and a linear combination of independent normal densities is emphasized. (Contains 3 tables and 1 figure.)

  18. A mixture theory for geophysical fluids

    Directory of Open Access Journals (Sweden)

    A. C. Eringen

    2004-01-01

    Full Text Available A continuum theory is developed for a geophysical fluid consisting of two species. Balance laws are given for the individual components of the mixture, modeled as micropolar viscous fluids. The continua allow independent rotational degrees of freedom, so that the fluids can exhibit couple stresses and a non-symmetric stress tensor. The second law of thermodynamics is used to develop constitutive equations. Linear constitutive equations are constituted for a heat conducting mixture, each species possessing separate viscosities. Field equations are obtained and boundary and initial conditions are stated. This theory is relevant to an atmospheric mixture consisting of any two species from rain, snow and/or sand. Also, this is a continuum theory for oceanic mixtures, such as water and silt, or water and oil spills, etc.

  19. The disentangling number for phylogenetic mixtures

    CERN Document Server

    Sullivant, Seth

    2011-01-01

    We provide a logarithmic upper bound for the disentangling number on unordered lists of leaf labeled trees. This results is useful for analyzing phylogenetic mixture models. The proof depends on interpreting multisets of trees as high dimensional contingency tables.

  20. Mapping the jamming transition of bidisperse mixtures

    Science.gov (United States)

    Koeze, D. J.; Vågberg, D.; Tjoa, B. B. T.; Tighe, B. P.

    2016-03-01

    We systematically map out the jamming transition of all 2D bidisperse mixtures of frictionless disks in the hard-particle limit. The critical volume fraction, mean coordination number, number of rattlers, structural order parameters, and bulk modulus each show a rich variation with mixture composition and particle size ratio, and can therefore be tuned by choosing certain mixtures. We identify two local minima in the critical volume fraction, both of which have low structural order; one minimum is close to the widely studied 50 : 50 mixture of particles with a ratio of radii of 1 : 1.4. We also identify a region at low size ratios characterized by increased structural order and high rattler fractions, with a corresponding enhancement in the stiffness.

  1. Ultrafiltration of a polymer-electrolyte mixture

    NARCIS (Netherlands)

    Vonk, P; Noordman, T.R; Schippers, D; Tilstra, B; Wesselingh, J.A

    1997-01-01

    We present a mathematical model to describe the ultrafiltration behaviour of polymer-electrolyte mixtures. The model combines the proper thermodynamic forces (pressure, chemical potential and electrical potential differences) with multicomponent diffusion theory. The model is verified with experimen

  2. Model structure selection in convolutive mixtures

    DEFF Research Database (Denmark)

    Dyrholm, Mads; Makeig, Scott; Hansen, Lars Kai

    2006-01-01

    The CICAAR algorithm (convolutive independent component analysis with an auto-regressive inverse model) allows separation of white (i.i.d) source signals from convolutive mixtures. We introduce a source color model as a simple extension to the CICAAR which allows for a more parsimoneous represent......The CICAAR algorithm (convolutive independent component analysis with an auto-regressive inverse model) allows separation of white (i.i.d) source signals from convolutive mixtures. We introduce a source color model as a simple extension to the CICAAR which allows for a more parsimoneous...... representation in many practical mixtures. The new filter-CICAAR allows Bayesian model selection and can help answer questions like: 'Are we actually dealing with a convolutive mixture?'. We try to answer this question for EEG data....

  3. Model structure selection in convolutive mixtures

    DEFF Research Database (Denmark)

    Dyrholm, Mads; Makeig, S.; Hansen, Lars Kai

    2006-01-01

    The CICAAR algorithm (convolutive independent component analysis with an auto-regressive inverse model) allows separation of white (i.i.d) source signals from convolutive mixtures. We introduce a source color model as a simple extension to the CICAAR which allows for a more parsimonious represent......The CICAAR algorithm (convolutive independent component analysis with an auto-regressive inverse model) allows separation of white (i.i.d) source signals from convolutive mixtures. We introduce a source color model as a simple extension to the CICAAR which allows for a more parsimonious...... representation in many practical mixtures. The new filter-CICAAR allows Bayesian model selection and can help answer questions like: ’Are we actually dealing with a convolutive mixture?’. We try to answer this question for EEG data....

  4. Resistances for heat and mass transfer through a liquid–vapor interface in a binary mixture

    NARCIS (Netherlands)

    Glavatskiy, K.S.; Bedeaux, D.

    2010-01-01

    In this paper we calculate the interfacial resistances to heat and mass transfer through a liquid–vapor interface in a binary mixture. We use two methods, the direct calculation from the actual nonequilibrium solution and integral relations, derived earlier. We verify, that integral relations, being

  5. Spectrophotometric determination of acidity constants of some anthraquinones and anthrones in methanol-water mixtures.

    Science.gov (United States)

    Shamsipur, M; Ghasemi, J; Tamaddon, F; Sharghi, H

    1993-05-01

    The acidity constants of some synthetic derivatives of 9,10-anthraquinone and 9-anthrone in methanol-water mixtures at 25 degrees have been determined spectrophotometrically. A linear reverse relationship is observed between pK(a1) of all acids and the mole fraction of methanol. The influence of substituents in the molecular structure on the ionization constants is discussed.

  6. Resistances for heat and mass transfer through a liquid–vapor interface in a binary mixture

    NARCIS (Netherlands)

    Glavatskiy, K.S.; Bedeaux, D.

    2010-01-01

    In this paper we calculate the interfacial resistances to heat and mass transfer through a liquid–vapor interface in a binary mixture. We use two methods, the direct calculation from the actual nonequilibrium solution and integral relations, derived earlier. We verify, that integral relations, being

  7. DETERMINATION AND QUANTIFICATION OF NON-AQUEOUS PHASE LIQUID MIXTURES IN ENVIRONMENTAL MEDIA

    Energy Technology Data Exchange (ETDEWEB)

    Rucker, G

    2006-09-22

    It is important to recognize the presence of Non-Aqueous Phase Liquids (NAPLs) in soils at a waste site in order to design and construct a successful remediation system. NAPLs often manifest as a complex, multi-component mixture of organic compounds that can occur in environmental media, such as vadose zone soil, where the mixture will partition and equilibrate with soil particles, pore vapor, and pore water. Complex organic mixtures can greatly complicate the determination and quantification of NAPL in soil due to inter-media transfer. NAPL thresholds can also change because of mixture physical properties and can disguise the presence of NAPL. A unique analytical method and copyrighted software have been developed at the Department of Energy's Savannah River Site that facilitates solution of this problem. The analytical method uses a classic chemistry approach and applies the principals of solubility limit theory, Raoult's Law, and equilibrium chemistry to derive an accurate estimation of NAPL presence and quantity. The method is unique because it calculates an exact result that is mass balanced for each physical state, chemical mixture component, and mixture characteristics. The method is also unique because the solution can be calculated on both a wet weight and dry weight basis--a factor which is often overlooked. The software includes physical parameters for 300 chemicals in a database that self-loads into the model to save time. The method accommodates up to 20 different chemicals in a multi-component mixture analysis. A robust data display is generated including important parameters of the components and mixture including: NAPL thresholds for individual chemical components within the mixture, mass distribution in soil for each physical state, molar fractions, density, vapor pressure, solubility, mass balance, media concentrations, residual saturation, and modest graphing capabilities. This method and software are power tools to simplify otherwise

  8. Laboratory performance of asphalt rubber mixtures

    OpenAIRE

    Fontes, Liseane; Trichês, Glicério; Pais, Jorge; Pereira, Paulo; Minhoto, Manuel

    2009-01-01

    Asphalt rubber mixtures are one of the most promising techniques to extend the service life of asphalt pavement overlays. Asphalt rubber binder is composed of crumb rubber from reclaimed tires and conventional asphalt. The asphalt rubber binder can be obtained through wet process in two different systems: tire rubber modified asphalt binder (produced at industrial plants) and continuous blending (produced in asphalt plants). This study presents a laboratory evaluation of asphalt rubber mixtur...

  9. Assessing sanitary mixtures in East African cities

    OpenAIRE

    Letema, S.C.

    2012-01-01

    The urbanisation of poverty and informality in East African cities poses a threat to environmental health, perpetuates social exclusion and inequalities, and creates service gaps (UN-Habitat, 2008). This makes conventional sanitation provision untenable citywide, giving rise to the emergence of sanitation mixtures. Sanitation mixtures have different scales, institutional arrangements, user groups, and rationalities for their establishment, location, and management. For assessing the performan...

  10. Fitting mixture distributions to phenylthiocarbamide (PTC) sensitivity.

    OpenAIRE

    Jones, P N; G.J. McLachlan

    1991-01-01

    A technique for fitting mixture distributions to phenylthiocarbamide (PTC) sensitivity is described. Under the assumptions of Hardy-Weinberg equilibrium, a mixture of three normal components is postulated for the observed distribution, with the mixing parameters corresponding to the proportions of the three genotypes associated with two alleles A and a acting at a single locus. The corresponding genotypes AA, Aa, and aa are then considered to have separate means and variances. This paper is c...

  11. Using Big Data Analytics to Address Mixtures Exposure

    Science.gov (United States)

    The assessment of chemical mixtures is a complex issue for regulators and health scientists. We propose that assessing chemical co-occurrence patterns and prevalence rates is a relatively simple yet powerful approach in characterizing environmental mixtures and mixtures exposure...

  12. Catalyst mixture for aromatic hydrocarbon synthesis

    Energy Technology Data Exchange (ETDEWEB)

    Minderhoud, J.K.; Huizinga, T.; Sie, S.T.

    1989-06-06

    The present invention is concerned with catalyst mixtures consisting of two catalysts, characterized in that one, which is based on zinc, is capable of catalysing the conversion of a H/sub 2//CO mixture into oxygen-containing organic compounds, and the other is a crystalline iron/boron silicate which, after one hour's calcination in air at 500/sup 0/C, has the following properties: a certain X-ray powder diffraction pattern and, in the formula that represents the composition of the silicate, expressed in moles of the oxides, a SiO/sub 2//Fe/sub 2/O/sub 3 molar ratio that is 20-2000, a SiO/sub 2//B/sub 2/O/sub 3/ molar ratio 50-5000, and a Fe/sub 2/O/sub 3//B/sub 2/O/sub 3/ molar ratio higher than 1.0. Said catalyst mixtures show higher aromatics selectivity in the preparation of hydrocarbon mixtures from H/sub 2//CO mixtures than such a mixture comprising an iron silicate instead of the above iron/boron silicates. 3 tabs.

  13. When mixtures of hard-sphere-like colloids do not behave as mixtures of hard spheres.

    Science.gov (United States)

    Germain, Ph; Malherbe, J G; Amokrane, S

    2004-10-01

    The validity of the concept of "hard-sphere-like" particles for mixtures of colloids is questioned from a theoretical point of view. This concerns the class of pseudobinary mixtures in which the nonsteric interactions between the colloids are "residual" (with very small range and moderate strength). It is shown that contrary to common expectation, such interactions may have unexpected consequences on the theoretical phase diagram. The distinction between this situation and true solute-solvent mixtures is emphasized.

  14. Efficient speaker verification using Gaussian mixture model component clustering.

    Energy Technology Data Exchange (ETDEWEB)

    De Leon, Phillip L. (New Mexico State University, Las Cruces, NM); McClanahan, Richard D.

    2012-04-01

    In speaker verification (SV) systems that employ a support vector machine (SVM) classifier to make decisions on a supervector derived from Gaussian mixture model (GMM) component mean vectors, a significant portion of the computational load is involved in the calculation of the a posteriori probability of the feature vectors of the speaker under test with respect to the individual component densities of the universal background model (UBM). Further, the calculation of the sufficient statistics for the weight, mean, and covariance parameters derived from these same feature vectors also contribute a substantial amount of processing load to the SV system. In this paper, we propose a method that utilizes clusters of GMM-UBM mixture component densities in order to reduce the computational load required. In the adaptation step we score the feature vectors against the clusters and calculate the a posteriori probabilities and update the statistics exclusively for mixture components belonging to appropriate clusters. Each cluster is a grouping of multivariate normal distributions and is modeled by a single multivariate distribution. As such, the set of multivariate normal distributions representing the different clusters also form a GMM. This GMM is referred to as a hash GMM which can be considered to a lower resolution representation of the GMM-UBM. The mapping that associates the components of the hash GMM with components of the original GMM-UBM is referred to as a shortlist. This research investigates various methods of clustering the components of the GMM-UBM and forming hash GMMs. Of five different methods that are presented one method, Gaussian mixture reduction as proposed by Runnall's, easily outperformed the other methods. This method of Gaussian reduction iteratively reduces the size of a GMM by successively merging pairs of component densities. Pairs are selected for merger by using a Kullback-Leibler based metric. Using Runnal's method of reduction, we

  15. CONSTITUTIVE RELATION OF UNSATURATED SOIL BY USE OF THE MIXTURE THEORY(I)—NONLINEAR CONSTITUTIVE EQUATIONS AND FIELD EQUATIONS

    Institute of Scientific and Technical Information of China (English)

    HUANGYi; ZHANGYin-ke

    2003-01-01

    The nonlinear constitutive equations and field equations of unsaturated soils were constructed on the basis of mixture theory.The soils were treated as the mixture composed of three constituents.First ,from the researches of soil mechanics,some basic assumptions about the unsaturated soil mixture were mode,and the entropy inequality unsaturated soil mixture was derived.Then,with the common method usually used to deal with the constitutive problems in mixture theory,the nonlinear constitutive equations were obtained.Finally,putting the constiutive equtions of constituents into the balance equations of momentum,the nonlinear field equations of constitutents into the balance equations of momentum,the nonliear field equations of constitutents were set up.The balance equation of energy of unsaturated soil was also given,and thus the complete equations for solving the thermodynamic process of unsaturated soil was formed.

  16. CONSTITUTIVE RELATION OF UNSATURATED SOIL BY USE OF THE MIXTURE THEORY(Ⅰ)-NONLINEAR CONSTITUTIVE EQUATIONS AND FIELD EQUATIONS

    Institute of Scientific and Technical Information of China (English)

    黄义; 张引科

    2003-01-01

    The nonlinear constitutive equations and field equations of unsaturated soils were cons tructed on the basis of mixture theory. The soils were treated as the mixture composed of three constituents. First, from the researches of soil mechanics, some basic assumptions about the unsaturated soil mixture were made, and the entropy inequality of unsaturated soil mixture was derived. Then, with the common method usually used to deal with the constitutive problems in mixture theory, the nonlinear constitutive equations were obtained. Finally, putting the constitutive equations of constituents into the balance equations of momentum, the nonlinear field equations of constituents were set up. The balance equation of energy of unsaturated soil was also given, and thus the complete equations for solving the thermodynamic process of unsaturated soil was formed.

  17. Flashpoint prediction for ternary mixtures of alcohols with water for CFD simulation of unsteady flame propagation during explosion

    Science.gov (United States)

    Skřínský, Jan; Vereš, Ján; Ševčíková, Silvie Petránková

    2016-06-01

    Aqueous solutions of binary and ternary mixtures of alcohols are of considerable interest for a wide range of scientists and technologists. Simple dimensionless experimental formulae based on rational reciprocal and polynomial functions are proposed for correlation of the flashpoint data of binary mixtures of two components. The formulae are based on data obtained from flashpoint experiments and predictions. The main results are the derived experimental flashpoint values for ternary mixtures of two aqueous-organic solutions and the model prediction of maximum explosion pressure values for the studied mixtures. Potential application for the results concerns the assessment of fire and explosion hazards, and the development of inherently safer designs for chemical processes containing binary and ternary partially miscible mixtures of an aqueous-organic system. The goal of this article is to present the results of modelling using these standard models and to demonstrate its importance in the area of CFD simulation.

  18. Monocyte-Derived Suppressor Cells in Transplantation.

    Science.gov (United States)

    Ochando, Jordi; Conde, Patricia; Bronte, Vincenzo

    Myeloid-derived suppressor cells (MDSC) are cells of myeloid origin with enhanced suppressive function. They are negative regulators of the immune responses and comprise a heterogeneous mixture of immunosuppressive cells of monocytic (M-MDSC) and granulocytic (G-MDSC) origin. A more recent nomenclature proposes the term "suppressive monocyte derived cells" (suppressive MCs) to define CSF1/CSF2-dependent mouse suppressor cells that develop from common monocyte progenitors (cMoPs) after birth. Here, we review the literature about monocytic-derived cells with demonstrated suppressor function in vitro and in vivo within the context of solid organ transplantation.

  19. Identifiability of large phylogenetic mixture models.

    Science.gov (United States)

    Rhodes, John A; Sullivant, Seth

    2012-01-01

    Phylogenetic mixture models are statistical models of character evolution allowing for heterogeneity. Each of the classes in some unknown partition of the characters may evolve by different processes, or even along different trees. Such models are of increasing interest for data analysis, as they can capture the variety of evolutionary processes that may be occurring across long sequences of DNA or proteins. The fundamental question of whether parameters of such a model are identifiable is difficult to address, due to the complexity of the parameterization. Identifiability is, however, essential to their use for statistical inference.We analyze mixture models on large trees, with many mixture components, showing that both numerical and tree parameters are indeed identifiable in these models when all trees are the same. This provides a theoretical justification for some current empirical studies, and indicates that extensions to even more mixture components should be theoretically well behaved. We also extend our results to certain mixtures on different trees, using the same algebraic techniques.

  20. ASPECTS OF THERMODYNAMICS OF POLYMER MIXTURES

    Institute of Scientific and Technical Information of China (English)

    CHAI Zhikuan

    1987-01-01

    In this brief review article some aspects of the thermodynamics of polymer mixtures are discussed,mainly based on the author's research. The studies of poly (methyl methacrylate)/chlorinated polyethylene (CPE), poly (butyl acrylate)/CPE and CPE/CPE (different chlorine content) mixture verify the "dissimilarity" and "similarity" principles for predicting miscibility of polymer mixtures. The sign of heat of mixing of oligomeric analogues is not sufficient in predicting the miscibility. The Flory equation of state theory has been applied to simulate the phase boundaries of polymer mixtures. The empirical entropy parameter Q12 plays an important role in the calculation, this reduces the usefulness of the theory. With energy parameter X12 ≠ 0 and Q12 ≠ 0 the spinodals so calculated are reasonable compared to experiments.A hole model was suggested for the statistics of polymer mixtures. The new hole theory combines the features of both the Flory equation of state theory and the Sanchez lattice fluid theory and can be reduced to them under some conditions.

  1. Asbestos Tailings as Aggregates for Asphalt Mixture

    Institute of Scientific and Technical Information of China (English)

    LIU Xinoming; XU Linrong

    2011-01-01

    To use many asbestos tailings collected in Ya-Lu highway, and to explore the feasibility of using asbestos tailings as aggregates in common asphalt mixtures, and properties of some asphalt mixtures were evaluated as well. X-ray diffraction (XRD), X-ray fluorescent (XRF), and atomic absorption spectrophotometry (AAS) were employed to determine the solid waste content of copper, zinc, lead, and cadmium. Volume properties and pavement performances of AC-25 asphalt mixture with asbestos tailings were also evaluated compared with those with basalt as aggregates.XRD and XRF measurement results infer that asbestos tailing is an excellent road material. Volume properties of AC-25 asphalt mixture with asbestos tailings satisfied the related specifications. No heavy metals and toxic pollution were detected in AAS test and the value of pH test is 8.23, which is help to the adhesion with asphalt in the asphalt concrete. When compared with basalt, high temperature property and the resistance to low temperature cracking of AC-25 asphalt mixture was improved by using asbestos tailings as aggregates. In-service AC-25 asphalt pavement with asbestos tailings also presented excellent performance and British Pendulum Number (BPN) coefficient of surface.

  2. Predicting the Reflectance of Paper Dyed with Ink Mixtures by Describing Light Scattering as a Function of Ink Absorbance

    OpenAIRE

    Rousselle, Fabrice; Hébert, Mathieu; Hersch, Roger

    2010-01-01

    We consider the problem of predicting the spectral reflectance of paper samples immersed in ink mixtures of varying ink concentrations. Relying on an adapted version of the Kubelka-Munk theory, we predict the reflectances of the samples dyed by ink mixtures. We first derive a method to calculate the effective scattering coefficient of an inked paper sample as a function of its absorbance coefficient. Then we learn from a single sample the reduction in ink concentrations when two inks are mixe...

  3. Density and molar volumes of imidazolium-based ionic liquid mixtures and prediction by the Jouyban-Acree model

    Science.gov (United States)

    Ghani, Noraini Abd; Sairi, Nor Asrina; Mat, Ahmad Nazeer Che; Khoubnasabjafari, Mehry; Jouyban, Abolghasem

    2016-11-01

    The density of imidazolium-based ionic liquid, 1-ethyl-3-methylimidazolium diethylphosphate with sulfolane were measured at atmospheric pressure. The experiments were performed at T= (293 - 343) K over the complete mole fractions. Physical and thermodynamic properties such as molar volumes, V0, and excess molar volumes, VE for this binary mixtures were derived from the experimental density data. The Jouyban-Acree model was exploited to correlate the physicochemical properties (PCPs) of binary mixtures at various mole fractions and temperatures.

  4. A cold energy mixture theory for the equation of state in solid and porous metal mixtures

    Science.gov (United States)

    Zhang, X. F.; Qiao, L.; Shi, A. S.; Zhang, J.; Guan, Z. W.

    2011-07-01

    Porous or solid multi-component mixtures are ubiquitous in nature and extensively used as industrial materials such as multifunctional energetic structural materials (MESMs), metallic and ceramic powder for shock consolidation, and porous armor materials. In order to analyze the dynamic behavior of a particular solid or porous metal mixture in any given situation, a model is developed to calculate the Hugoniot data for solid or porous mixtures using only static thermodynamic properties of the components. The model applies the cold energy mixture theory to calculate the isotherm of the components to avoid temperature effects on the mixtures. The isobaric contribution from the thermodynamic equation of state is used to describe the porous material Hugoniot. Dynamic shock responses of solid or porous powder mixtures compacted by shock waves have been analyzed based on the mixture theory and Hugoniot for porous materials. The model is tested on both single-component porous materials such as aluminum 2024, copper, and iron; and on multi-component mixtures such as W/Cu, Fe/Ni, and Al/Ni. The theoretical calculations agree well with the corresponding experimental and simulation results. The present model produces satisfactory correlation with the experimentally obtained Hugoniot data for solid porous materials over a wide pressure range.

  5. Effects of volume fraction condition on thermodynamic restrictions in mixture theory

    Institute of Scientific and Technical Information of China (English)

    牛永红; 苗天德

    2002-01-01

    Volume fraction condition is a true constraint that must be taken into consideration in deducing the thermodynamic restrictions of mixture theory applying the axiom of dissipation. For a process to be admissible, the constraints imposed by the volume fraction condition include not only the equation obtained by taking its material derivative with respect to the motion of a given phase, but also those by taking its spatial gradient. The thermodynamic restrictions are deduced under the complete constraints, the results obtained are consistent for the mixtures with or without a compressible phase,and in which the free energy of each phase depends on the densities of all phases.

  6. QIKMIX: a quick-turnaround computer program for computing opacities of mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Abdallah, J. Jr.; Huebner, W.F.

    1979-05-01

    QIKMIX is a quick-turnaround computer code developed to compute the radiative Rosseland mean opacity of specified mixtures at specified temperature and density points. The QIKLIB data base, which QIKMIX uses, has been derived from the OPLIB library. For most mixtures, QIKMIX can compute opacities over a temperature range of 50 to 25,000 eV in less than 1 min of CDC 7600 computer time. The purpose of this report is to discuss the QIKLIB data base and the operation of the QIKMIX code.

  7. Quasiparticle Lifetime in Ultracold Fermionic Mixtures with Density and Mass Imbalance

    DEFF Research Database (Denmark)

    Lan, Zhihao; Bruun, Georg; Lobo, Carlos

    2013-01-01

    We show that atomic Fermi mixtures with density and mass imbalance exhibit a rich diversity of scaling laws for the quasiparticle decay rate beyond the quadratic energy and temperature dependence of conventional Fermi liquids. For certain densities and mass ratios, the decay rate is linear, whereas...... plasmas. The Fermi mixtures can in this sense span a whole range of seemingly diverse and separate physical systems. Our results are derived in the weakly interacting limit, making them quantitatively reliable. The different regimes can be detected with radio-frequency spectroscopy....

  8. Adaptive Mixture Methods Based on Bregman Divergences

    CERN Document Server

    Donmez, Mehmet A; Kozat, Suleyman S

    2012-01-01

    We investigate adaptive mixture methods that linearly combine outputs of $m$ constituent filters running in parallel to model a desired signal. We use "Bregman divergences" and obtain certain multiplicative updates to train the linear combination weights under an affine constraint or without any constraints. We use unnormalized relative entropy and relative entropy to define two different Bregman divergences that produce an unnormalized exponentiated gradient update and a normalized exponentiated gradient update on the mixture weights, respectively. We then carry out the mean and the mean-square transient analysis of these adaptive algorithms when they are used to combine outputs of $m$ constituent filters. We illustrate the accuracy of our results and demonstrate the effectiveness of these updates for sparse mixture systems.

  9. Computer simulation of rod-sphere mixtures

    CERN Document Server

    Antypov, D

    2003-01-01

    Results are presented from a series of simulations undertaken to investigate the effect of adding small spherical particles to a fluid of rods which would otherwise represent a liquid crystalline (LC) substance. Firstly, a bulk mixture of Hard Gaussian Overlap particles with an aspect ratio of 3:1 and hard spheres with diameters equal to the breadth of the rods is simulated at various sphere concentrations. Both mixing-demixing and isotropic-nematic transition are studied using Monte Carlo techniques. Secondly, the effect of adding Lennard-Jones particles to an LC system modelled using the well established Gay-Berne potential is investigated. These rod-sphere mixtures are simulated using both the original set of interaction parameters and a modified version of the rod-sphere potential proposed in this work. The subject of interest is the internal structure of the binary mixture and its dependence on density, temperature, concentration and various parameters characterising the intermolecular interactions. Both...

  10. Quasi-chemical approximation for polyatomic mixtures

    CERN Document Server

    Dávila, M V; Matoz-Fernandez, D A; Ramirez-Pastor, A J

    2016-01-01

    The statistical thermodynamics of binary mixtures of polyatomic species was developed on a generalization in the spirit of the lattice-gas model and the quasi-chemical approximation (QCA). The new theoretical framework is obtained by combining: (i) the exact analytical expression for the partition function of non-interacting mixtures of linear $k$-mers and $l$-mers (species occupying $k$ sites and $l$ sites, respectively) adsorbed in one dimension, and its extension to higher dimensions; and (ii) a generalization of the classical QCA for multicomponent adsorbates and multisite-occupancy adsorption. The process is analyzed through the partial adsorption isotherms corresponding to both species of the mixture. Comparisons with analytical data from Bragg-Williams approximation (BWA) and Monte Carlo simulations are performed in order to test the validity of the theoretical model. Even though a good fitting is obtained from BWA, it is found that QCA provides a more accurate description of the phenomenon of adsorpti...

  11. Efficient radiative transfer in dust grain mixtures

    CERN Document Server

    Wolf, S

    2003-01-01

    The influence of a dust grain mixture consisting of spherical dust grains with different radii and/or chemical composition on the resulting temperature structure and spectral energy distribution of a circumstellar shell is investigated. The comparison with the results based on an approximation of dust grain parameters representing the mean optical properties of the corresponding dust grain mixture reveal that (1) the temperature dispersion of a real dust grain mixture decreases substantially with increasing optical depth, converging towards the temperature distribution resulting from the approximation of mean dust grain parameters, and (2) the resulting spectral energy distributions do not differ by more than 10% if >= 2^5 grain sizes are considered which justifies the mean parameter approximation and the many results obtained under its assumption so far. Nevertheless, the dust grain temperature dispersion at the inner boundary of a dust shell may amount to >>100K and has therefore to be considered in the cor...

  12. Two-Microphone Separation of Speech Mixtures

    DEFF Research Database (Denmark)

    Pedersen, Michael Syskind; Wang, DeLiang; Larsen, Jan

    2008-01-01

    Separation of speech mixtures, often referred to as the cocktail party problem, has been studied for decades. In many source separation tasks, the separation method is limited by the assumption of at least as many sensors as sources. Further, many methods require that the number of signals within...... the recorded mixtures be known in advance. In many real-world applications, these limitations are too restrictive. We propose a novel method for underdetermined blind source separation using an instantaneous mixing model which assumes closely spaced microphones. Two source separation techniques have been...... similar signals. Using two microphones, we can separate, in principle, an arbitrary number of mixed speech signals. We show separation results for mixtures with as many as seven speech signals under instantaneous conditions. We also show that the proposed method is applicable to segregate speech signals...

  13. Modeling methods for mixture-of-mixtures experiments applied to a tablet formulation problem.

    Science.gov (United States)

    Piepel, G F

    1999-01-01

    During the past few years, statistical methods for the experimental design, modeling, and optimization of mixture experiments have been widely applied to drug formulation problems. Different methods are required for mixture-of-mixtures (MoM) experiments in which a formulation is a mixture of two or more "major" components, each of which is a mixture of one or more "minor" components. Two types of MoM experiments are briefly described. A tablet formulation optimization example from a 1997 article in this journal is used to illustrate one type of MoM experiment and corresponding empirical modeling methods. Literature references that discuss other methods for MoM experiments are also provided.

  14. Mutation spectra of complex environmental mixtures

    Energy Technology Data Exchange (ETDEWEB)

    DeMarini, D.M. [EPA, Research Triangle Park, NC (United States)

    1997-10-01

    Bioassay-directed chemical analysis of complex environmental mixtures has indicated that much of the genotoxic activity of mixtures is due to the presence of one or a few classes or chemicals within the mixture. We have extended this observation to the molecular level by using colony probe hybridization and PCR/DNA sequence analysis to determine the mutation spectra of {approximately}8,000 revertants induced by a variety of complex mixtures and their chemical fractions in TA100 and TA98 of Salmonella. For urban air, >80% of mutagenic activity was due to a base/neutral fraction that contained primarily PAHs. The mutation spectrum induced by unfractionated urban air was not significantly different from that produced by a model PAH, B(a)P. The mutation spectrum induced by organic extracts of chlorinated drinking water were similar to those produced by the chlorinated furanone MX, which accounted for {approximately}20% of the mutagenic activity of the samples. The base/neutral fraction of municipal waste incinerator emissions accounted for the primary class of mutations induced by the emissions, and a polar neutral fraction accounted for the secondary class of mutations induced by the emissions. The primary class of mutations induced by cigarette smoke condensate in TA100 (GC {yields} TA) is also the primary class of mutations in the p53 gene of lung tumors of cigarette smokers. These results confirm at the molecular level that the mutations induced by a complex mixture reflect the dominance of one or a few classes of chemicals within the mixture.

  15. Thermophysical Properties of Fluids and Fluid Mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Sengers, Jan V.; Anisimov, Mikhail A.

    2004-05-03

    The major goal of the project was to study the effect of critical fluctuations on the thermophysical properties and phase behavior of fluids and fluid mixtures. Long-range fluctuations appear because of the presence of critical phase transitions. A global theory of critical fluctuations was developed and applied to represent thermodynamic properties and transport properties of molecular fluids and fluid mixtures. In the second phase of the project, the theory was extended to deal with critical fluctuations in complex fluids such as polymer solutions and electrolyte solutions. The theoretical predictions have been confirmed by computer simulations and by light-scattering experiments. Fluctuations in fluids in nonequilibrium states have also been investigated.

  16. Paternity testing that involves a DNA mixture.

    Science.gov (United States)

    Mortera, Julia; Vecchiotti, Carla; Zoppis, Silvia; Merigioli, Sara

    2016-07-01

    Here we analyse a complex disputed paternity case, where the DNA of the putative father was extracted from his corpse that had been inhumed for over 20 years. This DNA was contaminated and appears to be a mixture of at least two individuals. Furthermore, the mother's DNA was not available. The DNA mixture was analysed so as to predict the most probable genotypes of each contributor. The major contributor's profile was then used to compute the likelihood ratio for paternity. We also show how to take into account a dropout allele and the possibility of mutation in paternity testing.

  17. Mixture Distribution Approach In Financial Risk Analysis

    OpenAIRE

    Kocak, Keziban; Calis, Nazif; Unal, Deniz

    2014-01-01

    In recent years, major changes occurred in the prices of stock exchange appeared the necessity of measuring the financial risk. Nowadays, Value-atRisk (VaR) is often used to calculate the financial risk. Parametric methods which need normality are mostly used in the calculation of VaR.If the financial data does not fit the normal distribution, mixture of normal distribution models can be fitted to this data. In this study, the financial risk is calculated by using normal mixture distribution ...

  18. Boiler derating for coal-water mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Horney, F.A.; Nolte, F.S.

    1983-11-01

    The authors demonstrated a method for approximating the derating required when converting an oil or natural gas fired unit to a coal-water mixture. If the results show that a retrofit to coal-water mixture appears economically reasonable, then a more detailed analysis should be made by the boiler manufacturer whose methods are more precise than the methods of this paper. The expense of having the boiler manufacturer make a precise analysis can be avoided if the results of the analysis of this paper show conversion not to be viable.

  19. Conditional Density Approximations with Mixtures of Polynomials

    DEFF Research Database (Denmark)

    Varando, Gherardo; López-Cruz, Pedro L.; Nielsen, Thomas Dyhre

    2015-01-01

    Mixtures of polynomials (MoPs) are a non-parametric density estimation technique especially designed for hybrid Bayesian networks with continuous and discrete variables. Algorithms to learn one- and multi-dimensional (marginal) MoPs from data have recently been proposed. In this paper we introduce...... is found. We illustrate and study the methods using data sampled from known parametric distributions, and we demonstrate their applicability by learning models based on real neuroscience data. Finally, we compare the performance of the proposed methods with an approach for learning mixtures of truncated...

  20. Flows and chemical reactions in homogeneous mixtures

    CERN Document Server

    Prud'homme, Roger

    2013-01-01

    Flows with chemical reactions can occur in various fields such as combustion, process engineering, aeronautics, the atmospheric environment and aquatics. The examples of application chosen in this book mainly concern homogeneous reactive mixtures that can occur in propellers within the fields of process engineering and combustion: - propagation of sound and monodimensional flows in nozzles, which may include disequilibria of the internal modes of the energy of molecules; - ideal chemical reactors, stabilization of their steady operation points in the homogeneous case of a perfect mixture and c

  1. Mixture for removing tar and paraffin deposits

    Energy Technology Data Exchange (ETDEWEB)

    kamenshchikov, F.A.; Frolov, M.A.; Golovin, I.N.; Khusainov, Z.M.; Smirnov, Ya.L.; Suchkov, B.M.

    1981-05-23

    Mixture is claimed for removing tar and paraffin deposits (TPD) on the basis of the butyl-benzene fraction (BBF), which is intended to more efficiently remove TPD from the surface of refinery equipment, additionally has piperylene, isoprene and isoamine with the following ratio of the components: piperylene, 19-31%; isoprene, 8-12%; isoamines, 8-12%, while BBF, the rest. The efficiency of the given compositions was assessed by the rate at which the plates were cleaned of TPD and pure commercial paraffin. It has been shown that BBF dissolves 4-6 times faster in the given mixture than in BBF and pyperylene.

  2. Viscosity of oil and water mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Corlett, A.E.; Hall, A.R.W. [National Engineering Laboratory, Glasgow (United Kingdom)

    1999-07-01

    A study was performed to investigate the apparent viscosity of oil and water mixtures using the pressure loss along a horizontal pipe. Water fractions between 100% to 5% were examined at three flow velocities and three temperatures. Four combinations of crude oil and saline solution were used. Tests found that the mixture viscosity exhibited a peak at the position of phase inversion. The value of this maximum viscosity depended upon the temperature and fluid combination used, but not the velocity. Physical properties of the fluids were important factors in the viscosity/water fraction behaviour. (author)

  3. Dielectrophoretic manipulation of the mixture of isotropic and nematic liquid

    Science.gov (United States)

    Kim, Soo-Dong; Lee, Bomi; Kang, Shin-Woong; Song, Jang-Kun

    2015-08-01

    In various applications involving liquid crystals, the manipulation of the nanoscale molecular assembly and microscale director alignment is highly useful. Here we show that a nematic-isotropic mixture, a unique bi-liquid system, has potential for the fabrication of microstructures having an ordered phase within a disordered phase, or vice versa. The volume expansion and shrinkage, migration, splitting, mergence and elongation of one phase within the other are easily accomplished via thermal treatment and dielectrophoretic manipulation. This is particularly achievable when one phase is suspended in the middle. In that case, a highly biased ordered-phase preference of surfaces, that is, the nematic-philic nature of a polyimide layer and the nematic-phobic nature of a self-assembled monolayer of chlorosilane derivatives, is used. Further, by combining this approach with photopolymerization, the patterned microstructure is solidified as a patterned polymer film having both isotropic and anisotropic molecular arrangements simultaneously, or as a template with a morphological variation.

  4. Mixture interlayer for high performance organic-inorganic perovskite photodetectors

    Science.gov (United States)

    Tang, Feng; Chen, Qi; Chen, Lei; Ye, Fengye; Cai, Jinhua; Chen, Liwei

    2016-09-01

    Organic-inorganic perovskites are promising light absorbing active materials for photodetectors; however, the performance of current organic-inorganic perovskite-based photodetectors are limited by the high dark current due to hole injection at the cathode interlayer typically composed of fullerene derivatives. We have developed a mixture interlayer by simply blending polymethyl methacrylate (PMMA) with [6,6]-phenyl-C61-butyric acidmethyl ester (PCBM). Scanning Kelvin probe microscopy imaging reveals that the presence of PMMA reduced the work function of the PCBM:PMMA interlayer, which leads to increased energy barrier for hole injection and better hole-blocking property. Optimized perovskite photodetector with PCBM:PMMA hole-blocking interlayer exhibits a high detectivity of 1.1 × 1013 Jones, a broad linear dynamic range of 112 dB, and a fast response time of 2.2 μs.

  5. Optimization of Internal Thermally Coupled Distillation Columns of Nonideal Mixture

    Institute of Scientific and Technical Information of China (English)

    刘兴高; 徐用懋; 钱积新

    2001-01-01

    Internal thermally coupled distillation column(ITCDIC) is a frontier in energy saving distillation research. In this paper, the optimal assessment on the energy saving and the operating cost for ITCDIC of nonideal mixture is explored. An evaluating method is proposed, and the pertinent optimization model is then derived. The ethanol-water system is studied as an illustrative example. The optimization results show that the maximum energy saving in ITCDIC process is about 35% and the maximum operating cost saving in ITCDIC process is about 30%,as compared with a conventional distillation column(CDIC) under the minimum reflux ratio operating; the optimal operating pressure of the rectifying section is found to be around 0.25 MPa; the effects of the feed composition,operating pressure and the heat transfer rate on operation are also found and analyzed. It is revealed that ITCDIC process possesses high energy saving potential and promising economical prospect.

  6. MixtureTree annotator: a program for automatic colorization and visual annotation of MixtureTree.

    Directory of Open Access Journals (Sweden)

    Shu-Chuan Chen

    Full Text Available The MixtureTree Annotator, written in JAVA, allows the user to automatically color any phylogenetic tree in Newick format generated from any phylogeny reconstruction program and output the Nexus file. By providing the ability to automatically color the tree by sequence name, the MixtureTree Annotator provides a unique advantage over any other programs which perform a similar function. In addition, the MixtureTree Annotator is the only package that can efficiently annotate the output produced by MixtureTree with mutation information and coalescent time information. In order to visualize the resulting output file, a modified version of FigTree is used. Certain popular methods, which lack good built-in visualization tools, for example, MEGA, Mesquite, PHY-FI, TreeView, treeGraph and Geneious, may give results with human errors due to either manually adding colors to each node or with other limitations, for example only using color based on a number, such as branch length, or by taxonomy. In addition to allowing the user to automatically color any given Newick tree by sequence name, the MixtureTree Annotator is the only method that allows the user to automatically annotate the resulting tree created by the MixtureTree program. The MixtureTree Annotator is fast and easy-to-use, while still allowing the user full control over the coloring and annotating process.

  7. MixtureTree annotator: a program for automatic colorization and visual annotation of MixtureTree.

    Science.gov (United States)

    Chen, Shu-Chuan; Ogata, Aaron

    2015-01-01

    The MixtureTree Annotator, written in JAVA, allows the user to automatically color any phylogenetic tree in Newick format generated from any phylogeny reconstruction program and output the Nexus file. By providing the ability to automatically color the tree by sequence name, the MixtureTree Annotator provides a unique advantage over any other programs which perform a similar function. In addition, the MixtureTree Annotator is the only package that can efficiently annotate the output produced by MixtureTree with mutation information and coalescent time information. In order to visualize the resulting output file, a modified version of FigTree is used. Certain popular methods, which lack good built-in visualization tools, for example, MEGA, Mesquite, PHY-FI, TreeView, treeGraph and Geneious, may give results with human errors due to either manually adding colors to each node or with other limitations, for example only using color based on a number, such as branch length, or by taxonomy. In addition to allowing the user to automatically color any given Newick tree by sequence name, the MixtureTree Annotator is the only method that allows the user to automatically annotate the resulting tree created by the MixtureTree program. The MixtureTree Annotator is fast and easy-to-use, while still allowing the user full control over the coloring and annotating process.

  8. A Skew-Normal Mixture Regression Model

    Science.gov (United States)

    Liu, Min; Lin, Tsung-I

    2014-01-01

    A challenge associated with traditional mixture regression models (MRMs), which rest on the assumption of normally distributed errors, is determining the number of unobserved groups. Specifically, even slight deviations from normality can lead to the detection of spurious classes. The current work aims to (a) examine how sensitive the commonly…

  9. Uniform design of experiments with mixtures

    Institute of Scientific and Technical Information of China (English)

    王元; 方开泰

    1996-01-01

    Consider a design of experiments with mixtures:0≤ai

  10. Modeling text with generalizable Gaussian mixtures

    DEFF Research Database (Denmark)

    Hansen, Lars Kai; Sigurdsson, Sigurdur; Kolenda, Thomas

    2000-01-01

    We apply and discuss generalizable Gaussian mixture (GGM) models for text mining. The model automatically adapts model complexity for a given text representation. We show that the generalizability of these models depends on the dimensionality of the representation and the sample size. We discuss...

  11. The Coffee-Milk Mixture Problem Revisited

    Science.gov (United States)

    Marion, Charles F.

    2015-01-01

    This analysis of a problem that is frequently posed at professional development workshops, in print, and on the Web--the coffee-milk mixture riddle--illustrates the timeless advice of George Pólya's masterpiece on problem solving in mathematics, "How to Solve It." In his book, Pólya recommends that problems previously solved and put…

  12. Quantification of complex mixtures by NMR

    NARCIS (Netherlands)

    Duynhoven, van J.P.M.; Velzen, van E.; Jacobs, D.M.

    2013-01-01

    NMR has firmly established itself as an analytical tool that can quantify analyte concentrations in complex mixtures in a rapid, cost-effective, accurate and precise manner. Here, the technological advances with respect to instrumentation, sample preparation, data acquisition and data processing ove

  13. Toxicology of chemical mixtures: International perspective

    NARCIS (Netherlands)

    Feron, V.J.; Cassee, F.R.; Groten, J.P.

    1998-01-01

    This paper reviews major activities outside the United States on human health issues related to chemical mixtures. In Europe an international study group on combination effects has been formed and has started by defining synergism and antagonism. Successful research programs in Europe include the de

  14. Mixture toxicity of PBT-like chemicals

    DEFF Research Database (Denmark)

    Syberg, Kristian; Dai, Lina; Ramskov, Tina

    beyond that of the individual components. Firstly, the effects of three chemicals with PBT-like properties (acetyl cedrene, pyrene and triclosan) was examined on the freshwater snail, Potamopyrgus antipodarum. Secondly, mixture bioaccumulation of the same three chemicals were assessed experimentally...

  15. Concrete mixture characterization. Cementitious barriers partnership

    Energy Technology Data Exchange (ETDEWEB)

    Langton, C. [Savannah River Site (SRS), Aiken, SC (United States). Savannah River National Lab. (SRNL); Protiere, Yannick [SIMCO Technologies, Inc., Quebec (Canada)

    2014-12-01

    This report summarizes the characterization study performed on two concrete mixtures used for radioactive waste storage. Both mixtures were prepared with approximately 425 kg of binder. The testing protocol mostly focused on determining the transport properties of the mixtures; volume of permeable voids (porosity), diffusion coefficients, and water permeability were evaluated. Tests were performed after different curing durations. In order to obtain data on the statistical distribution of transport properties, the measurements after 2 years of curing were performed on 10+ samples. Overall, both mixtures exhibited very low tortuosities and permeabilities, a direct consequence of their low water-to-binder ratio and the use of supplementary cementitious materials. The data generated on 2-year old samples showed that porosity, tortuosity and permeability follow a normal distribution. Chloride ponding tests were also performed on test samples. They showed limited chloride ingress, in line with measured transport properties. These test results also showed that both materials react differently with chloride, a consequence of the differences in the binder chemical compositions.

  16. Predicting diffusivities in dense fluid mixtures

    Directory of Open Access Journals (Sweden)

    C. DARIVA

    1999-09-01

    Full Text Available In this work the Enskog solution of the Boltzmann equation, as corrected by Speedy, together with the Weeks-Chandler-Andersen (WCA perturbation theory of liquids is employed in correlating and predicting self-diffusivities of dense fluids. Afterwards this theory is used to estimate mutual diffusion coefficients of solutes at infinite dilution in sub and supercritical solvents. We have also investigated the behavior of Fick diffusion coefficients in the proximity of a binary vapor-liquid critical point since this subject is of great interest for extraction purposes. The approach presented here, which makes use of a density and temperature dependent hard-sphere diameter, is shown to be excellent for predicting diffusivities in dense pure fluids and fluid mixtures. The calculations involved highly nonideal mixtures as well as systems with high molecular asymmetry. The predicted diffusivities are in good agreement with the experimental data for the pure and binary systems. The methodology proposed here makes only use of pure component information and density of mixtures. The simple algebraic relations are proposed without any binary adjustable parameters and can be readily used for estimating diffusivities in multicomponent mixtures.

  17. Self-assembly models for lipid mixtures

    Science.gov (United States)

    Singh, Divya; Porcar, Lionel; Butler, Paul; Perez-Salas, Ursula

    2006-03-01

    Solutions of mixed long and short (detergent-like) phospholipids referred to as ``bicelle'' mixtures in the literature, are known to form a variety of different morphologies based on their total lipid composition and temperature in a complex phase diagram. Some of these morphologies have been found to orient in a magnetic field, and consequently bicelle mixtures are widely used to study the structure of soluble as well as membrane embedded proteins using NMR. In this work, we report on the low temperature phase of the DMPC and DHPC bicelle mixture, where there is agreement on the discoid structures but where molecular packing models are still being contested. The most widely accepted packing arrangement, first proposed by Vold and Prosser had the lipids completely segregated in the disk: DHPC in the rim and DMPC in the disk. Using data from small angle neutron scattering (SANS) experiments, we show how radius of the planar domain of the disks is governed by the effective molar ratio qeff of lipids in aggregate and not the molar ratio q (q = [DMPC]/[DHPC] ) as has been understood previously. We propose a new quantitative (packing) model and show that in this self assembly scheme, qeff is the real determinant of disk sizes. Based on qeff , a master equation can then scale the radii of disks from mixtures with varying q and total lipid concentration.

  18. Flexible Rasch Mixture Models with Package psychomix

    Directory of Open Access Journals (Sweden)

    Hannah Frick

    2012-05-01

    Full Text Available Measurement invariance is an important assumption in the Rasch model and mixture models constitute a flexible way of checking for a violation of this assumption by detecting unobserved heterogeneity in item response data. Here, a general class of Rasch mixture models is established and implemented in R, using conditional maximum likelihood estimation of the item parameters (given the raw scores along with flexible specification of two model building blocks: (1 Mixture weights for the unobserved classes can be treated as model parameters or based on covariates in a concomitant variable model. (2 The distribution of raw score probabilities can be parametrized in two possible ways, either using a saturated model or a specification through mean and variance. The function raschmix( in the R package psychomix provides these models, leveraging the general infrastructure for fitting mixture models in the flexmix package. Usage of the function and its associated methods is illustrated on artificial data as well as empirical data from a study of verbally aggressive behavior.

  19. Spinodal decomposition of chemically reactive binary mixtures

    Science.gov (United States)

    Lamorgese, A.; Mauri, R.

    2016-08-01

    We simulate the influence of a reversible isomerization reaction on the phase segregation process occurring after spinodal decomposition of a deeply quenched regular binary mixture, restricting attention to systems wherein material transport occurs solely by diffusion. Our theoretical approach follows a diffuse-interface model of partially miscible binary mixtures wherein the coupling between reaction and diffusion is addressed within the frame of nonequilibrium thermodynamics, leading to a linear dependence of the reaction rate on the chemical affinity. Ultimately, the rate for an elementary reaction depends on the local part of the chemical potential difference since reaction is an inherently local phenomenon. Based on two-dimensional simulation results, we express the competition between segregation and reaction as a function of the Damköhler number. For a phase-separating mixture with components having different physical properties, a skewed phase diagram leads, at large times, to a system converging to a single-phase equilibrium state, corresponding to the absolute minimum of the Gibbs free energy. This conclusion continues to hold for the critical phase separation of an ideally perfectly symmetric binary mixture, where the choice of final equilibrium state at large times depends on the initial mean concentration being slightly larger or less than the critical concentration.

  20. Toxicity of metal mixtures to chick embryos

    Energy Technology Data Exchange (ETDEWEB)

    Birge, W.J.; Roberts, O.W.; Black, J.A.

    1976-09-01

    The toxic effects of mercury/selenium and certain other metal mixtures on the chick embryo are examined to determine whether antagonistic, additive or synergistic interactions occur. White Plymouth Rock chicken eggs were treated by yolk injection with cadmium chloride, mercuric chloride, zinc chloride and sodium selenate. Test aliquots were injected prior to incubation using the needle track procedure. Using a sample size of 200, percent survival was determined as hatchability of experimental eggs/controls. Metal mixtures used included mercury/cadmium, mercury/selenium, mercury/zinc, cadmium/selenium, and cadmium/zinc. Except for mercury/selenium, all other metal mixtures gave actual values that were within 5% of those for additive toxic effects. Actual hatchability frequencies for test concentrations of mercury/selenium indicated a moderate degree of synergism. Results indicate that the strong mercury/selenium synergism which affects embryonic development in the carp does not apply for the chick embryo; that most two-way combinations of cadmium, mercury, selenium and zinc exert purely additive effects on chick hatchability; and that these metal mixtures give no discernible antagonistic interactions which affect survival of chick embryos. (MFB)

  1. Using Regression Mixture Analysis in Educational Research

    Directory of Open Access Journals (Sweden)

    Cody S. Ding

    2006-11-01

    Full Text Available Conventional regression analysis is typically used in educational research. Usually such an analysis implicitly assumes that a common set of regression parameter estimates captures the population characteristics represented in the sample. In some situations, however, this implicit assumption may not be realistic, and the sample may contain several subpopulations such as high math achievers and low math achievers. In these cases, conventional regression models may provide biased estimates since the parameter estimates are constrained to be the same across subpopulations. This paper advocates the applications of regression mixture models, also known as latent class regression analysis, in educational research. Regression mixture analysis is more flexible than conventional regression analysis in that latent classes in the data can be identified and regression parameter estimates can vary within each latent class. An illustration of regression mixture analysis is provided based on a dataset of authentic data. The strengths and limitations of the regression mixture models are discussed in the context of educational research.

  2. Two-microphone Separation of Speech Mixtures

    DEFF Research Database (Denmark)

    2006-01-01

    of Speech Mixtures," 2006, submited for journal publication. See also, [2] Michael Syskind Pedersen, DeLiang Wang, Jan Larsen and Ulrik Kjems: "Overcomplete Blind Source Separation by Combining ICA and Binary Time-Frequency Masking," in proceedings of IEEE International workshop on Machine Learning...

  3. Structure of cholesterol/ceramide monolayer mixtures

    DEFF Research Database (Denmark)

    Scheffer, L.; Solomonov, I.; Weygand, M.J.

    2005-01-01

    The structure of monolayers of cholesterol/ ceramide mixtures was investigated using grazing incidence x-ray diffraction, immunofluorescence, and atomic force microscopy techniques. Grazing incidence x-ray diffraction measurements showed the existence of a crystalline mixed phase of the two...

  4. Mixture model analysis of complex samples

    NARCIS (Netherlands)

    Wedel, M; ter Hofstede, F; Steenkamp, JBEM

    1998-01-01

    We investigate the effects of a complex sampling design on the estimation of mixture models. An approximate or pseudo likelihood approach is proposed to obtain consistent estimates of class-specific parameters when the sample arises from such a complex design. The effects of ignoring the sample desi

  5. Numerical Solution of Hard-Core Mixtures

    OpenAIRE

    Buhot, Arnaud; Krauth, Werner

    1997-01-01

    We study the equilibrium phase diagram of binary mixtures of hard spheres as well as of parallel hard cubes. A superior cluster algorithm allows us to establish and to access the demixed phase for both systems and to investigate the subtle interplay between short-range depletion and long-range demixing.

  6. Pool Boiling of Hydrocarbon Mixtures on Water

    Energy Technology Data Exchange (ETDEWEB)

    Boee, R.

    1996-09-01

    In maritime transport of liquefied natural gas (LNG) there is a risk of spilling cryogenic liquid onto water. The present doctoral thesis discusses transient boiling experiments in which liquid hydrocarbons were poured onto water and left to boil off. Composition changes during boiling are believed to be connected with the initiation of rapid phase transition in LNG spilled on water. 64 experimental runs were carried out, 14 using pure liquid methane, 36 using methane-ethane, and 14 using methane-propane binary mixtures of different composition. The water surface was open to the atmosphere and covered an area of 200 cm{sup 2} at 25 - 40{sup o}C. The heat flux was obtained by monitoring the change of mass vs time. The void fraction in the boiling layer was measured with a gamma densitometer, and a method for adapting this measurement concept to the case of a boiling cryogenic liquid mixture is suggested. Significant differences in the boil-off characteristics between pure methane and binary mixtures revealed by previous studies are confirmed. Pure methane is in film boiling, whereas the mixtures appear to enter the transitional boiling regime with only small amounts of the second component added. The results indicate that the common assumption that LNG will be in film boiling on water because of the high temperature difference, may be questioned. Comparison with previous work shows that at this small scale the results are influenced by the experimental apparatus and procedures. 66 refs., 76 figs., 28 tabs.

  7. Mixtures of Ultracold Fermions with Unequal Masses

    Science.gov (United States)

    de Melo, Carlos A. R. Sa

    2008-05-01

    The quantum phases of ultracold fermions with unequal masses are discussed in continuum and lattice models for a wide variety of mixtures which exhibit Feshbach resonances, e.g., mixtures of ^6Li and ^40K. The evolution of superfluidity from the Bardeen-Cooper-Schrieffer (BCS) to the Bose-Einstein condensation (BEC) regime in the continuum is analyzed as a function of scattering parameter, population imbalance and mass anisotropy. In the continuum case, regions corresponding to normal, phase-separated or coexisting uniform-superfluid/excess-fermion phases are identified and the possibility of topological phase transitions is discussed [1]. For optical lattices, the phase diagrams as a function of interaction strength, population imbalance, filling fraction and tunneling parameters are presented [2]. In addition to the characteristic phases of the continuum, a series of insulating phases emerge in the phase diagrams of optical lattices, including a Bose-Mott insulator (BMI), a Fermi-Pauli insulator (FPI), a phase-separated BMI/FPI mixture, and a Bose-Fermi checkerboard (BFC) phase. Lastly, the effects of harmonic traps and the emergence of unusual shell structures are discussed for mixtures of fermions with unequal masses. [1] M. Iskin, and C. A. R. S' a de Melo, Phys. Rev. Lett 97, 100404 (2006); [2] M. Iskin, and C. A. R. S' a de Melo, Phys. Rev. Lett. 99, 080403 (2007).

  8. Cementitious barriers partnership concrete mixture characterization

    Energy Technology Data Exchange (ETDEWEB)

    Langton, C. [Savannah River Site (SRS), Aiken, SC (United States). Savannah River National Lab. (SRNL); Protiere, Yannick [SIMCO Technologies, Inc., Quebec (Canada)

    2014-12-01

    This report summarizes the characterization study performed on two concrete mixtures used for radioactive waste storage. Both mixtures were prepared with approximately 425 kg of binder. The testing protocol mostly focused on determining the transport properties of the mixtures; volume of permeable voids (porosity), diffusion coefficients, and water permeability were evaluated. Tests were performed after different curing durations. In order to obtain data on the statistical distribution of transport properties, the measurements after 2 years of curing were performed on 10+ samples. Overall, both mixtures exhibited very low tortuosities and permeabilities, a direct consequence of their low water-to-binder ratio and the use of supplementary cementitious materials. The data generated on 2-year old samples showed that porosity, tortuosity and permeability follow a normal distribution. Chloride ponding tests were also performed on test samples. They showed limited chloride ingress, in line with measured transport properties. These test results also showed that both materials react differently with chloride, a consequence of the differences in the binder chemical compositions.

  9. Some aspects of symmetric Gamma process mixtures

    OpenAIRE

    Naulet, Zacharie; Barat, Eric

    2015-01-01

    In this article, we present some specific aspects of symmetric Gamma process mixtures for use in regression models. We propose a new Gibbs sampler for simulating the posterior and we establish adaptive posterior rates of convergence related to the Gaussian mean regression problem.

  10. The Coffee-Milk Mixture Problem Revisited

    Science.gov (United States)

    Marion, Charles F.

    2015-01-01

    This analysis of a problem that is frequently posed at professional development workshops, in print, and on the Web--the coffee-milk mixture riddle--illustrates the timeless advice of George Pólya's masterpiece on problem solving in mathematics, "How to Solve It." In his book, Pólya recommends that problems previously solved and put…

  11. Toxicology of chemical mixtures: International perspective

    NARCIS (Netherlands)

    Feron, V.J.; Cassee, F.R.; Groten, J.P.

    1998-01-01

    This paper reviews major activities outside the United States on human health issues related to chemical mixtures. In Europe an international study group on combination effects has been formed and has started by defining synergism and antagonism. Successful research programs in Europe include the

  12. Gasification of biomass chars in steam-nitrogen mixture

    Energy Technology Data Exchange (ETDEWEB)

    Haykiri-Acma, H. [Department of Chemical Engineering, Chemical and Metallurgical Engineering Faculty, Istanbul Technical University, 34469 Maslak, Istanbul (Turkey)]. E-mail: hanzade@itu.edu.tr; Yaman, S. [Department of Chemical Engineering, Chemical and Metallurgical Engineering Faculty, Istanbul Technical University, 34469 Maslak, Istanbul (Turkey); Kucukbayrak, S. [Department of Chemical Engineering, Chemical and Metallurgical Engineering Faculty, Istanbul Technical University, 34469 Maslak, Istanbul (Turkey)

    2006-05-15

    Some agricultural and waste biomass samples such as sunflower shell, pinecone, rapeseed, cotton refuse and olive refuse were first pyrolyzed in nitrogen, and then, their chars were gasified in a gas mixture of steam and nitrogen. Experiments were performed using the thermogravimetric analysis technique. Pyrolysis of the biomass samples was performed at a heating rate of 20 K/min from ambient to 1273 K in a dynamic nitrogen atmosphere of 40 cm{sup 3} min{sup -1}. The obtained chars were cooled to ambient temperature and then gasified up to 1273 K in a dynamic atmosphere of 40 cm{sup 3} min{sup -1} of a mixture of steam and nitrogen. Derivative thermogravimetric analysis profiles from gasification of the chars were derived, and the mass losses from the chars were interpreted in terms of temperature. It was concluded that gasification characteristics of biomass chars were fairly dependent on the biomass properties such as ash and fixed carbon contents and the constituents present in the ash. Different mechanisms in the three temperature intervals, namely water desorption at lower temperatures, decomposition of hydroxide minerals to oxide minerals and formation of carbon monoxide at medium temperatures and production of hydrogen at high temperatures govern the behavior of the char during the gasification process. The chars from pinecone and sunflower shell could be easily gasified under the mentioned conditions. In order to further raise the conversion yields, long hold times should be applied at high temperatures. However, the chars from rapeseed and olive refuse were not gasified satisfactorily. Low ash content and high fixed carbon content biomass materials are recommended for use in gasification processes when char from pyrolysis at elevated temperatures is used as a feedstock.

  13. Thermodynamic Study on the Azeotropic Mixture Composed of Ethanol and Toluene

    Institute of Scientific and Technical Information of China (English)

    南照东; 谭志诚; 邢军

    2005-01-01

    The molar heat capacity of the azeotropic mixture composed of ethanol and toluene was measured by a high precision adiabatic calorimeter from 80 to 320 K. The glass transition and phase transitions of the azeotropic mixture were determined based on the heat capacity measurements. A glass transition at 103.350 K was found. A solid-solid phase transition at 127.282 K, two solid-liquid phase transitions at 153.612 and 160.584 K were observed, which correspond to the transition of metastable crystal to stable crystal of ethanol and the melting of ethanol and toluene, respectively. The thermodynamic functions and the excess ones of the mixture relative to the standard temperature 298.15 K were derived based on the relationships of the thermodynamic functions and the function of the measured heat capacity with respect to temperature.

  14. Relative binding affinities of chlorophylls in peridinin-chlorophyll-protein reconstituted with heterochlorophyllous mixtures.

    Science.gov (United States)

    Brotosudarmo, T H P; Mackowski, S; Hofmann, E; Hiller, R G; Bräuchle, C; Scheer, H

    2008-01-01

    Peridinin-chlorophyll-protein (PCP), containing differently absorbing chlorophyll derivatives, are good models with which to study energy transfer among monomeric chlorophylls (Chls) by both bulk and single-molecule spectroscopy. They can be obtained by reconstituting the N-terminal domain of the protein (N-PCP) with peridinin and chlorophyll mixtures. Upon dimerization of these "half-mers", homo- and heterochlorophyllous complexes are generated, that correspond structurally to monomeric protomers of native PCP from Amphidinium carterae. Heterochlorophyllous complexes contain two different Chls in the two halves of the complete structure. Here, we report reconstitution of N-PCP with binary mixtures of Chl a, Chl b, and [3-acetyl]-Chl a. The ratios of the pigments were varied in the reconstitution mixture, and relative binding constants were determined from quantification of these pigments in the reconstituted PCPs. We find higher affinities for both Chl b and [3-acetyl]-Chl a than for the native pigment, Chl a.

  15. Microscopic approach to critical behavior in 3He-4He mixtures. Effective Hamiltonian and instability

    Science.gov (United States)

    Singh, K. K.; Goswami, Partha

    1984-03-01

    A system of weakly interacting bosons and fermions is used as a model to develop a theory of critical behavior of 3He-4He mixtures. The fermion amplitudes and the short-wavelength boson amplitudes are eliminated from the problem within the framework of perturbation theory. The resulting effective boson Hamiltonian possesses interesting features. It implies an instability of the mixture and of its λ line when certain conditions are fulfilled. The coefficients associated with the quartic and six-operator terms of the effective Hamiltonian have properties characteristic of the classical Landau model often used to discuss tricritical behavior. The condition of stability derived for the mixture agrees with an earlier result of Cohen and Leeuwen for the degenerate phase but is in disagreement with their results for the nondegenerate phase.

  16. Blind separation of sources in nonlinear convolved mixture based on a novel network

    Institute of Scientific and Technical Information of China (English)

    胡英; 杨杰; 沈利

    2004-01-01

    Blind separation of independent sources from their nonlinear convoluted mixtures is a more realistic problem than from linear ones. A solution to this problem based on the Entropy Maximization principle is presented. First we propose a novel two-layer network as the de-mixing system to separate sources in nonlinear convolved mixture. In output layer of our network we use feedback network architecture to cope with convoluted mixtures. Then we derive learning algorithms for the two-layer network by maximizing the information entropy. Based on the comparison of the computer simulation results, it can be concluded that the proposed algorithm has a better nonlinear convolved blind signal separation effect than the H.H. Y' s algorithm.

  17. Molecular Code Division Multiple Access: Gaussian Mixture Modeling

    Science.gov (United States)

    Zamiri-Jafarian, Yeganeh

    Communications between nano-devices is an emerging research field in nanotechnology. Molecular Communication (MC), which is a bio-inspired paradigm, is a promising technique for communication in nano-network. In MC, molecules are administered to exchange information among nano-devices. Due to the nature of molecular signals, traditional communication methods can't be directly applied to the MC framework. The objective of this thesis is to present novel diffusion-based MC methods when multi nano-devices communicate with each other in the same environment. A new channel model and detection technique, along with a molecular-based access method, are proposed in here for communication between asynchronous users. In this work, the received molecular signal is modeled as a Gaussian mixture distribution when the MC system undergoes Brownian noise and inter-symbol interference (ISI). This novel approach demonstrates a suitable modeling for diffusion-based MC system. Using the proposed Gaussian mixture model, a simple receiver is designed by minimizing the error probability. To determine an optimum detection threshold, an iterative algorithm is derived which minimizes a linear approximation of the error probability function. Also, a memory-based receiver is proposed to improve the performance of the MC system by considering previously detected symbols in obtaining the threshold value. Numerical evaluations reveal that theoretical analysis of the bit error rate (BER) performance based on the Gaussian mixture model match simulation results very closely. Furthermore, in this thesis, molecular code division multiple access (MCDMA) is proposed to overcome the inter-user interference (IUI) caused by asynchronous users communicating in a shared propagation environment. Based on the selected molecular codes, a chip detection scheme with an adaptable threshold value is developed for the MCDMA system when the proposed Gaussian mixture model is considered. Results indicate that the

  18. Phase diagram of highly asymmetric binary hard-sphere mixtures.

    Science.gov (United States)

    Dijkstra, M; van Roij, R; Evans, R

    1999-05-01

    We study the phase behavior and structure of highly asymmetric binary hard-sphere mixtures. By first integrating out the degrees of freedom of the small spheres in the partition function we derive a formal expression for the effective Hamiltonian of the large spheres. Then using an explicit pairwise (depletion) potential approximation to this effective Hamiltonian in computer simulations, we determine fluid-solid coexistence for size ratios q=0.033, 0.05, 0.1, 0.2, and 1.0. The resulting two-phase region becomes very broad in packing fractions of the large spheres as q becomes very small. We find a stable, isostructural solid-solid transition for q0 the phase diagram mimics that of the sticky-sphere system. As expected, the radial distribution function g(r) and the structure factor S(k) of the effective one-component system show no sharp signature of the onset of the freezing transition and we find that at most points on the fluid-solid boundary the value of S(k) at its first peak is much lower than the value given by the Hansen-Verlet freezing criterion. Direct simulations of the true binary mixture of hard spheres were performed for q > or =0.05 in order to test the predictions from the effective Hamiltonian. For those packing fractions of the small spheres where direct simulations are possible, we find remarkably good agreement between the phase boundaries calculated from the two approaches-even up to the symmetric limit q=1 and for very high packings of the large spheres, where the solid-solid transition occurs. In both limits one might expect that an approximation which neglects higher-body terms should fail, but our results support the notion that the main features of the phase equilibria of asymmetric binary hard-sphere mixtures are accounted for by the effective pairwise depletion potential description. We also compare our results with those of other theoretical treatments and experiments on colloidal hard-sphere mixtures.

  19. Computer simulation of rod-sphere mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Antypov, Dmytro

    2003-07-01

    Results are presented from a series of simulations undertaken to investigate the effect of adding small spherical particles to a fluid of rods which would otherwise represent a liquid crystalline (LC) substance. Firstly, a bulk mixture of Hard Gaussian Overlap particles with an aspect ratio of 3:1 and hard spheres with diameters equal to the breadth of the rods is simulated at various sphere concentrations. Both mixing-demixing and isotropic-nematic transition are studied using Monte Carlo techniques. Secondly, the effect of adding Lennard-Jones particles to an LC system modelled using the well established Gay-Berne potential is investigated. These rod-sphere mixtures are simulated using both the original set of interaction parameters and a modified version of the rod-sphere potential proposed in this work. The subject of interest is the internal structure of the binary mixture and its dependence on density, temperature, concentration and various parameters characterising the intermolecular interactions. Both the mixing-demixing behaviour and the transitions between the isotropic and any LC phases have been studied for four systems which differ in the interaction potential between unlike particles. A range of contrasting microphase separated structures including bicontinuous, cubic, and micelle-like arrangement have been observed in bulk. Thirdly, the four types of mixtures previously studied in bulk are subjected to a static magnetic field. A variety of novel phases are observed for the cases of positive and negative anisotropy in the magnetic susceptibility. These include a lamellar structure, in which layers of rods are separated by layers of spheres, and a configuration with a self-assembling hexagonal array of spheres. Finally, two new models are presented to study liquid crystal mixtures in the presence of curved substrates. These are implemented for the cases of convex and concave spherical surfaces. The simulation results obtained in these geometries

  20. Experiments with Mixtures Designs, Models, and the Analysis of Mixture Data

    CERN Document Server

    Cornell, John A

    2011-01-01

    The most comprehensive, single-volume guide to conducting experiments with mixtures"If one is involved, or heavily interested, in experiments on mixtures of ingredients, one must obtain this book. It is, as was the first edition, the definitive work."-Short Book Reviews (Publication of the International Statistical Institute)"The text contains many examples with worked solutions and with its extensive coverage of the subject matter will prove invaluable to those in the industrial and educational sectors whose work involves the design and analysis of mixture experiments."-Journal of the Royal S

  1. Linking asphalt binder fatigue to asphalt mixture fatigue performance using viscoelastic continuum damage modeling

    Science.gov (United States)

    Safaei, Farinaz; Castorena, Cassie; Kim, Y. Richard

    2016-08-01

    Fatigue cracking is a major form of distress in asphalt pavements. Asphalt binder is the weakest asphalt concrete constituent and, thus, plays a critical role in determining the fatigue resistance of pavements. Therefore, the ability to characterize and model the inherent fatigue performance of an asphalt binder is a necessary first step to design mixtures and pavements that are not susceptible to premature fatigue failure. The simplified viscoelastic continuum damage (S-VECD) model has been used successfully by researchers to predict the damage evolution in asphalt mixtures for various traffic and climatic conditions using limited uniaxial test data. In this study, the S-VECD model, developed for asphalt mixtures, is adapted for asphalt binders tested under cyclic torsion in a dynamic shear rheometer. Derivation of the model framework is presented. The model is verified by producing damage characteristic curves that are both temperature- and loading history-independent based on time sweep tests, given that the effects of plasticity and adhesion loss on the material behavior are minimal. The applicability of the S-VECD model to the accelerated loading that is inherent of the linear amplitude sweep test is demonstrated, which reveals reasonable performance predictions, but with some loss in accuracy compared to time sweep tests due to the confounding effects of nonlinearity imposed by the high strain amplitudes included in the test. The asphalt binder S-VECD model is validated through comparisons to asphalt mixture S-VECD model results derived from cyclic direct tension tests and Accelerated Loading Facility performance tests. The results demonstrate good agreement between the asphalt binder and mixture test results and pavement performance, indicating that the developed model framework is able to capture the asphalt binder's contribution to mixture fatigue and pavement fatigue cracking performance.

  2. On $n$-derivations

    Directory of Open Access Journals (Sweden)

    Mohammad Hossein Sattari

    2016-06-01

    Full Text Available In this article, the notion of $n-$derivation is introduced for all integers $ngeq 2$. Although all derivations are $n-$derivations,  in general these notions are not equivalent. Some properties of ordinary derivations are  investigated for $n-$derivations. Also, we show that under certain mild condition  $n-$derivations are derivations.

  3. Properties of Direct Coal Liquefaction Residue Modified Asphalt Mixture

    Directory of Open Access Journals (Sweden)

    Jie Ji

    2017-01-01

    Full Text Available The objectives of this paper are to use Direct Coal Liquefaction Residue (DLCR to modify the asphalt binders and mixtures and to evaluate the performance of modified asphalt mixtures. The dynamic modulus and phase angle of DCLR and DCLR-composite modified asphalt mixture were analyzed, and the viscoelastic properties of these modified asphalt mixtures were compared to the base asphalt binder SK-90 and Styrene-Butadiene-Styrene (SBS modified asphalt mixtures. The master curves of the asphalt mixtures were shown, and dynamic and viscoelastic behaviors of asphalt mixtures were described using the Christensen-Anderson-Marasteanu (CAM model. The test results show that the dynamic moduli of DCLR and DCLR-composite asphalt mixtures are higher than those of the SK-90 and SBS modified asphalt mixtures. Based on the viscoelastic parameters of CAM models of the asphalt mixtures, the high- and low-temperature performance of DLCR and DCLR-composite modified asphalt mixtures are obviously better than the SK-90 and SBS modified asphalt mixtures. In addition, the DCLR and DCLR-composite modified asphalt mixtures are more insensitive to the frequency compared to SK-90 and SBS modified asphalt mixtures.

  4. Thermodiffusion in binary and ternary nonpolar hydrocarbon + alcohol mixtures

    Science.gov (United States)

    Eslamian, Morteza; Saghir, M. Ziad

    2012-12-01

    Thermodiffusion in complex mixtures, such as associating, molten metal, and polymer mixtures is difficult to model usually owing to the occurrence of a sign change in the thermodiffusion coefficient when the mixture concentration and temperature change. A mixture comprised of a nonpolar hydrocarbon and an alcohol is a complex and highly non-ideal mixture. In this paper an existing binary non-equilibrium thermodynamics model (Eslamian and Saghir, Physical Review E 80, 061201, 2009) developed for aqueous mixtures of alcohols is examined against the experimental data of binary nonpolar hydrocarbon and alcohol mixtures. For ternary mixtures, non-equilibrium thermodynamic expressions developed by the authors for aqueous mixtures of alcohols (Eslamian and Saghir, Canadian Journal of Chemical Engineering, DOI 10.1002/cjce.20581) is used to predict thermodiffusion coefficients of ternary nonpolar hydrocarbon and alcohol mixtures. The rationale behind the sign change is elucidated and attributed to an anomalous change in the molecular structure and therefore viscosity of such mixtures. Model predictions of thermodiffusion coefficients of binary mixtures predict a sign change consistent with the experimental data although the model is still too primitive to capture all structural complexities. For instance, in the methanol-benzene mixture where the model predictions are poorest, the viscosity data show that when concentration varies, the mixture's molecular structure experiences a severe change twice, the first major change leading to a maximum in the thermodiffusion coefficient, whereas the second change causes a sign change.

  5. Effects of mixtures of azole fungicides in postimplantation rat whole-embryo cultures.

    Science.gov (United States)

    Menegola, Elena; Di Renzo, Francesca; Metruccio, Francesca; Moretto, Angelo; Giavini, Erminio

    2013-11-01

    The effect of mixtures of azole fungicides on development of postimplantation rat whole-embryos cultured in vitro has been tested. On the basis of bench mark dose (BMD) modeling of the in vitro effect in rat embryo, the potency of 7 azoles was determined and compared. Then, relative potency factors have been derived based on either the NOAEL or on the BMD curve. Alternatively, each compound was used as index compound (IC), and IC-equivalent concentrations have been calculated for each mixture. Expected effects of such IC-equivalent concentrations of the mixture were derived from the appropriate BMD curve. Test mixture includes the agrochemicals triadimefon and imazalil (MIX2) or triadimefon, imazalil, and the clinically used fluconazole (MIX3) at their previously determined no-effect concentration, corresponding to approximately a benchmark response of 5-10 %. Subsequently, we tested the effect of a mixture of the agrochemicals triadimefon, imazalil, triadimenol, cyproconazole, tebuconazole, and flusilazole (MIX6) at concentration levels derived from their established human acceptable daily intake. MIX6 was also added with fluconazole at concentration levels indicated as the minimum therapeutically effective plasmatic concentration (MIX7A) or ten times this level (MIX7B). Generally, the experimental response was higher than the estimated one, by a factor of 2-6. Our data suggest that it is in principle correct to assume that azoles act as teratogens via a common mode of action and therefore should be grouped together for risk assessment. The synergistic effect needs to be confirmed with more combinations of concentrations/compounds in vitro and with specific in vivo experiments.

  6. [Estimation of Hunan forest carbon density based on spectral mixture analysis of MODIS data].

    Science.gov (United States)

    Yan, En-ping; Lin, Hui; Wang, Guang-xing; Chen, Zhen-xiong

    2015-11-01

    With the fast development of remote sensing technology, combining forest inventory sample plot data and remotely sensed images has become a widely used method to map forest carbon density. However, the existence of mixed pixels often impedes the improvement of forest carbon density mapping, especially when low spatial resolution images such as MODIS are used. In this study, MODIS images and national forest inventory sample plot data were used to conduct the study of estimation for forest carbon density. Linear spectral mixture analysis with and without constraint, and nonlinear spectral mixture analysis were compared to derive the fractions of different land use and land cover (LULC) types. Then sequential Gaussian co-simulation algorithm with and without the fraction images from spectral mixture analyses were employed to estimate forest carbon density of Hunan Province. Results showed that 1) Linear spectral mixture analysis with constraint, leading to a mean RMSE of 0.002, more accurately estimated the fractions of LULC types than linear spectral and nonlinear spectral mixture analyses; 2) Integrating spectral mixture analysis model and sequential Gaussian co-simulation algorithm increased the estimation accuracy of forest carbon density to 81.5% from 74.1%, and decreased the RMSE to 5.18 from 7.26; and 3) The mean value of forest carbon density for the province was 30.06 t · hm(-2), ranging from 0.00 to 67.35 t · hm(-2). This implied that the spectral mixture analysis provided a great potential to increase the estimation accuracy of forest carbon density on regional and global level.

  7. Ignition of alkane-rich FACE gasoline fuels and their surrogate mixtures

    KAUST Repository

    Sarathy, Mani

    2015-01-01

    Petroleum derived gasoline is the most used transportation fuel for light-duty vehicles. In order to better understand gasoline combustion, this study investigated the ignition propensity of two alkane-rich FACE (Fuels for Advanced Combustion Engines) gasoline test fuels and their corresponding PRF (primary reference fuel) blend in fundamental combustion experiments. Shock tube ignition delay times were measured in two separate facilities at pressures of 10, 20, and 40 bar, temperatures from 715 to 1500 K, and two equivalence ratios. Rapid compression machine ignition delay times were measured for fuel/air mixtures at pressures of 20 and 40 bar, temperatures from 632 to 745 K, and two equivalence ratios. Detailed hydrocarbon analysis was also performed on the FACE gasoline fuels, and the results were used to formulate multi-component gasoline surrogate mixtures. Detailed chemical kinetic modeling results are presented herein to provide insights into the relevance of utilizing PRF and multi-component surrogate mixtures to reproduce the ignition behavior of the alkane-rich FACE gasoline fuels. The two FACE gasoline fuels and their corresponding PRF mixture displayed similar ignition behavior at intermediate and high temperatures, but differences were observed at low temperatures. These trends were mimicked by corresponding surrogate mixture models, except for the amount of heat release in the first stage of a two-stage ignition events, when observed. © 2014 The Combustion Institute.

  8. Relative Explosive Strength of Some Explosive Mixtures Containing Urea and/or Peroxides

    Institute of Scientific and Technical Information of China (English)

    Ahmed K. HUSSEIN; Svatopluk ZEMAN; Muhamed SUCESKA; Marcela JUNGOVA

    2016-01-01

    Several mixtures, based on urea derivatives and some inorganic oxidants, including also alumina, were studied by means of ballistic mortar techniques with TNT as the reference standard. The detonation pressure(P), detonation velocity(D), detonation energy(Q), and volume of gaseous product at standard temperature and pressure (STP), V, were calculated using EXPLO5 V6.3 thermochemical code. The performance of the mixtures studied was discussed in relation to their thermal reactivity, determined by means of differential thermal analysis (DTA). It is shown that the presence of hydrogen peroxide in the form of its complex with urea (i.e. as UHP) has a positive influence on the explosive strength of the corresponding mixtures which is linked to the hydroxy-radical formation in the mixtures during their initiation reaction. These radicals might initiate (at least partially) powdered aluminum into oxidation in the CJ plane of the detonation wave. Mixtures containing UHP and magnesium are dangerous because of potential auto-ignition.

  9. Gas-liquid-liquid equilibria in mixtures of water, light gases, and hydrocarbons

    Energy Technology Data Exchange (ETDEWEB)

    Chao, K.C.

    1990-01-01

    Phase equilibrium in mixtures of water + light gases and water + heavy hydrocarbons has been investigated with the development of new local composition theory, new equations of state, and new experimental data. The preferential segregation and orientation of molecules due to different energies of molecular interaction has been simulated with square well molecules. Extensive simulation has been made for pure square well fluids and mixtures to find the local composition at wide ranges of states. A theory of local composition has been developed and an equation of state has been obtained for square well fluids. The new local composition theory has been embedded in several equations of state. The pressure of water is decoupled into a polar pressure and non-polar pressure according to the molecular model of water of Jorgensen et al. The polar pressure of water is combined with the BACK equation for the general description of polar fluids and their mixtures. Being derived from the steam table, the Augmented BACK equation is particularly suited for mixtures of water + non-polar substances such as the hydrocarbons. The hydrophobic character of the hydrocarbons had made their mixtures with water a special challenge. A new group contribution equation of state is developed to describe phase equilibrium and volumetric behavior of fluids while requiring only to know the molecular structure of the components. 15 refs., 1 fig.

  10. Thermodynamic perturbation theory for self-assembling mixtures of divalent single patch colloids.

    Science.gov (United States)

    Marshall, Bennett D; Chapman, Walter G

    2014-07-28

    In this work we extend Wertheim's thermodynamic perturbation theory (TPT) to binary mixtures (species A and species B) of patchy colloids were each species has a single patch which can bond a maximum of twice (divalent). Colloids are treated as hard spheres with a directional conical association site. We restrict the system such that only patches between unlike species share attractions; meaning there are AB attractions but no AA or BB attractions. The theory is derived in Wertheim's two density formalism for one site associating fluids. Since the patches are doubly bondable, associated chains, of all chain lengths, as well as 4-mer rings consisting of two species A and two species B colloids are accounted for. With the restriction of only AB attractions, triatomic rings of doubly bonded colloids, which dominate in the corresponding pure component case, cannot form. The theory is shown to be in good agreement with Monte Carlo simulation data for the structure and thermodynamics of these patchy colloid mixtures as a function of temperature, density, patch size and composition. It is shown that 4-mer rings dominate at low temperature, inhibiting the polymerization of the mixture into long chains. Mixtures of this type have been recently synthesized by researchers. This work provides the first theory capable of accurately modeling these mixtures.

  11. Mixture design approach for early stage formulation development of a transdermal delivery system.

    Science.gov (United States)

    Michaelis, M; Leopold, C S

    2015-01-01

    Transdermal delivery systems (TDS) consisting of mixtures of adhesives also named multiple polymer adhesive systems are rarely found in the market and research has only been performed on a few of them. Following the principles of ICH Q8, a Design of Experiments (DOE) approach was selected for the formulation development. For evaluation of the statistical method of "mixture design", blends of silicon adhesive, acrylic adhesive, oleyl alcohol as a surfactant and ibuprofen as a model drug were considered to be combined at different concentrations. A randomized design of 16 runs with five replicates and five runs to estimate the lack of fit (LOF) was generated. Samples were tested for adhesion properties, stability of the wet mixes, solubility of the API in the matrix and appearance of the matrix. After performing an ANOVA with the results, response surfaces of tack, shear adhesion, extent of creaming, crystallization behavior, droplet size and droplet size range were derived as contour plots. It could be shown that crystal growth of ibuprofen correlates well with droplet size and droplet size range, where lowest values for crystallization were found with mixtures containing small droplets. However, it was observed that oleyl alcohol showed no positive effect on the miscibility of the polymers and no improvement of the solubility of ibuprofen in the mixtures. With a reasonable number of experiments, the development of a design space for a TDS via mixture design gave valuable information on the product as well as on the interactions of the components.

  12. Thermophysical properties of binary mixtures of N,N-dimethylformamide with three cyclic ethers

    Directory of Open Access Journals (Sweden)

    Sinha Biswajit

    2013-01-01

    Full Text Available Densities and viscosities of the binary mixtures consisting of tetrahydrofuran (THF, 1,3-dioxolane (1,3-DO and 1,4-dioxane (1,4-DO with N,N-dimethylformamide (DMF over the entire range of composition were measured at temperatures 298.15, 308.15 and 318.15 K and at atmospheric pressure. Ultrasonic speeds of sound of these binary mixtures were measured at ambient temperature and atmospheric pressure (T = 298.15 K and P = 1.01×105 Pa. The various experimental data were utilized to derive excess molar volumes (VmE, excess viscosities (ηE, and excess isentropic compressibilities (κsE. Using the excess molar volumes (VmE, excess partial molar volumes (and and excess partial molar volumes at infinite dilution (and of each liquid component in the mixtures were derived and discussed. Excess molar volumes (VmE as a function of composition at ambient temperature and atmospheric pressure were used further to test the applicability of the Prigogine-Flory-Patterson (PFP theory to the experimental binaries. The excess properties were found to be either negative or positive depending on the nature of molecular interactions and structural effects of liquid mixtures. Em,1V Em,2VE0,m,1VE0,m,2V.

  13. The interdigitated gel phase in mixtures of cationic and zwitterionic phospholipids.

    Science.gov (United States)

    Smith, Eric A; Dea, Phoebe K

    2015-01-01

    To examine the phase behavior of mixtures of zwitterionic and cationic lipids we used three derivatives of 1,2-dipalmitoyl-sn-glycero-3-phosphocholine (DPPC). All three lipids are uniquely capable of spontaneously forming the interdigitated gel phase (LβI) under typical hydration conditions. The P-O-ethyl derivative, 1,2-dipalmitoyl-sn-glycero-3-ethylphosphocholine (EDPPC), was chosen as the cationic lipid. For the zwitterionic lipids, we use the ether-linked 1,2-di-O-hexadecyl-sn-glycero-3-phosphocholine, (DHPC) and the fluorine substituted 1-palmitoyl-2-(16-fluoropalmitoyl)-sn-glycero-3-phosphocholine (F-DPPC). Differential scanning calorimetry (DSC) and fluorescence spectroscopy were used to analyze the lipid mixtures. The F-DPPC/EDPPC mixtures are interdigitated at all lipid ratios below the main transition temperature (Tm). In addition, EDPPC stabilizes the interdigitated gel phase of DHPC until the ripple gel phase (Pβ') is eliminated and only the LβI to liquid crystalline phase (Lα) main transition remains. These results demonstrate that mixtures of cationic and zwitterionic lipids can be compatible with the interdigitated phase.

  14. PACE: Probabilistic Assessment for Contributor Estimation- A machine learning-based assessment of the number of contributors in DNA mixtures.

    Science.gov (United States)

    Marciano, Michael A; Adelman, Jonathan D

    2017-03-01

    The deconvolution of DNA mixtures remains one of the most critical challenges in the field of forensic DNA analysis. In addition, of all the data features required to perform such deconvolution, the number of contributors in the sample is widely considered the most important, and, if incorrectly chosen, the most likely to negatively influence the mixture interpretation of a DNA profile. Unfortunately, most current approaches to mixture deconvolution require the assumption that the number of contributors is known by the analyst, an assumption that can prove to be especially faulty when faced with increasingly complex mixtures of 3 or more contributors. In this study, we propose a probabilistic approach for estimating the number of contributors in a DNA mixture that leverages the strengths of machine learning. To assess this approach, we compare classification performances of six machine learning algorithms and evaluate the model from the top-performing algorithm against the current state of the art in the field of contributor number classification. Overall results show over 98% accuracy in identifying the number of contributors in a DNA mixture of up to 4 contributors. Comparative results showed 3-person mixtures had a classification accuracy improvement of over 6% compared to the current best-in-field methodology, and that 4-person mixtures had a classification accuracy improvement of over 20%. The Probabilistic Assessment for Contributor Estimation (PACE) also accomplishes classification of mixtures of up to 4 contributors in less than 1s using a standard laptop or desktop computer. Considering the high classification accuracy rates, as well as the significant time commitment required by the current state of the art model versus seconds required by a machine learning-derived model, the approach described herein provides a promising means of estimating the number of contributors and, subsequently, will lead to improved DNA mixture interpretation. Copyright © 2016

  15. Complex mixtures, complex responses: Assessing pharmaceutical mixtures using field and laboratory approaches

    Science.gov (United States)

    Schoenfuss, Heiko L.; Furlong, Edward T.; Phillips, Patrick J.; Scott, Tia-Marie; Kolpin, Dana W.; Cetkovic-Cvrlje, Marina; Lesteberg, Kelsey E.; Rearick, Daniel C.

    2016-01-01

    Pharmaceuticals are present in low concentrations (tramadol), a muscle relaxant (methocarbamol), a simple antidepressant mixture (fluoxetine, paroxetine, venlafaxine), a sleep aid (temazepam), or a complex mixture of all compounds. Larval minnow response to effluent exposure was not consistent. The 2010 exposures resulted in shorter exposed minnow larvae, whereas the larvae exposed in 2012 exhibited altered escape behavior. Mature minnows exhibited altered hepatosomatic indices, with the strongest effects in females and in mixture exposures. In addition, laboratory-exposed, mature male minnows exposed to all pharmaceuticals (except the selective serotonin reuptake inhibitor mixture) defended nest sites less rigorously than fish in the control group. Tramadol or antidepressant mixture exposure resulted in increased splenic T lymphocytes. Only male minnows exposed to whole effluent responded with increased plasma vitellogenin concentrations. Female minnows exposed to pharmaceuticals (except the opioid mixture) had larger livers, likely as a compensatory result of greater prominence of vacuoles in liver hepatocytes. The observed alteration of apical endpoints central to sustaining fish populations confirms that effluents containing waste streams from pharmaceutical formulation facilities can adversely impact fish populations but that the effects may not be temporally consistent. The present study highlights the importance of including diverse biological endpoints spanning levels of biological organization and life stages when assessing contaminant interactions.

  16. Phase structure of liposome in lipid mixtures.

    Science.gov (United States)

    Zhang, Tianxi; Li, Yuzhuo; Mueller, Anja

    2011-11-01

    Gas microbubbles present in ultrasound imaging contrast agents are stabilized by lipid aggregates that typically contain a mixture of lipids. In this study, the phase structure of the lipid mixtures that contained two or three lipids was investigated using three different methods: dynamic light scattering, (1)H NMR, and microfluidity measurements with fluorescence probes. Three lipids that are commonly present in imaging agents (DPPC, DPPE-PEG, and DPPA) were used. Two types of systems, two-lipid model systems and simulated imaging systems were investigated. The results show that liposomes were the dominant aggregates in all the samples studied. The polar PEG side chains from the PEGylated lipid lead to the formation of micelles and micellar aggregates in small sizes. In the ternary lipid systems, almost all the lipids were present in bilayers with micelles absent and free lipids at very low concentration. These results suggest that liposomes, not micelles, contribute to the stabilization of microbubbles in an ultrasound imaging contrast agent.

  17. Molecular thermodiffusion (thermophoresis) in liquid mixtures.

    Science.gov (United States)

    Semenov, Semen N; Schimpf, Martin E

    2005-10-01

    Thermodiffusion (thermophoresis) in liquid mixtures is theoretically examined using a hydrodynamic approach. Thermodiffusion is related to the local temperature-induced pressure gradient in the liquid layer surrounding the selected molecule and to the secondary macroscopic pressure gradient established in the system. The local pressure gradient is produced by excess pressure due to the asymmetry of interactions with surrounding molecules in a nonuniform temperature field. The secondary pressure gradient is considered an independent parameter related to the concentration gradient formed by volume forces, calculated from the generalized equations for mass transfer. Values of Soret coefficients for mixtures of toluene and -hexane are calculated using parameters in the literature. When the molecules are assumed to be similar in shape, the calculated Soret coefficients are lower than the empirical values found in the literature. However, by introducing an asymmetry parameter, which is calculated from independent measurements of component diffusion in the literature, very good agreement is obtained.

  18. Quantum state smoothing for classical mixtures

    CERN Document Server

    Tan, D; Mølmer, K; Murch, K W

    2016-01-01

    In quantum mechanics, wave functions and density matrices represent our knowledge about a quantum system and give probabilities for the outcomes of measurements. If the combined dynamics and measurements on a system lead to a density matrix $\\rho(t)$ with only diagonal elements in a given basis $\\{|n\\rangle\\}$, it may be treated as a classical mixture, i.e., a system which randomly occupies the basis states $|n\\rangle$ with probabilities $\\rho_{nn}(t)$. Fully equivalent to so-called smoothing in classical probability theory, subsequent probing of the occupation of the states $|n\\rangle$ improves our ability to retrodict what was the outcome of a projective state measurement at time $t$. Here, we show with experiments on a superconducting qubit that the smoothed probabilities do not, in the same way as the diagonal elements of $\\rho$, permit a classical mixture interpretation of the state of the system at the past time $t$.

  19. Sum of Bernoulli Mixtures: Beyond Conditional Independence

    Directory of Open Access Journals (Sweden)

    Taehan Bae

    2014-01-01

    Full Text Available We consider the distribution of the sum of Bernoulli mixtures under a general dependence structure. The level of dependence is measured in terms of a limiting conditional correlation between two of the Bernoulli random variables. The conditioning event is that the mixing random variable is larger than a threshold and the limit is with respect to the threshold tending to one. The large-sample distribution of the empirical frequency and its use in approximating the risk measures, value at risk and conditional tail expectation, are presented for a new class of models which we call double mixtures. Several illustrative examples with a Beta mixing distribution, are given. As well, some data from the area of credit risk are fit with the models, and comparisons are made between the new models and also the classical Beta-binomial model.

  20. Robust classification using mixtures of dependency networks

    DEFF Research Database (Denmark)

    Gámez, José A.; Mateo, Juan L.; Nielsen, Thomas Dyhre

    2008-01-01

    Dependency networks have previously been proposed as alternatives to e.g. Bayesian networks by supporting fast algorithms for automatic learning. Recently dependency networks have also been proposed as classification models, but as with e.g. general probabilistic inference, the reported speed......-ups are often obtained at the expense of accuracy. In this paper we try to address this issue through the use of mixtures of dependency networks. To reduce learning time and improve robustness when dealing with data sparse classes, we outline methods for reusing calculations across mixture components. Finally......, the proposed model is empirically compared to other state-of-the-art classifiers, both in terms of accuracy and learning time....

  1. Synergetic effect in a mixture of noble gases around the Paschen minimum

    Energy Technology Data Exchange (ETDEWEB)

    Despotovic, Dejan; Cvetic, Jovan; Stankovic, Koviljka; Osmokrovic, Predrag, E-mail: opredrag@verat.net [Faculty of Electrical Engineering, University of Belgrade, Bulevar kralja Aleksandra 73, 11000 Belgrade (Serbia)

    2014-01-15

    DC and pulse breakdown in the He-Ar gas mixture are investigated for small pressures and inter-electrode gaps. Expressions for calculating the breakdown voltage of a gas mixture are derived, assuming that breakdown occurs by way of the Townsend breakdown mechanism and that Maxwell spectrum can be used for the free electron gas. The parameters considered in experiments have been chosen so as to be of interest in designing gas-filled surge arresters. The obtained results demonstrate that the derived breakdown voltage expressions are correct, and that a suitable choice of parameters can produce a positive synergetic effect with regard to gas-filled surge arrester design. The latter issue is especially interesting for lowering the dc breakdown voltage of unconditioned electrodes.

  2. Use of Linear Spectral Mixture Model to Estimate Rice Planted Area Based on MODIS Data

    Directory of Open Access Journals (Sweden)

    Lei Wang

    2008-06-01

    Full Text Available MODIS (Moderate Resolution Imaging Spectroradiometer is a key instrument aboard the Terra (EOS AM and Aqua (EOS PM satellites. Linear spectral mixture models are applied to MOIDS data for the sub-pixel classification of land covers. Shaoxing county of Zhejiang Province in China was chosen to be the study site and early rice was selected as the study crop. The derived proportions of land covers from MODIS pixel using linear spectral mixture models were compared with unsupervised classification derived from TM data acquired on the same day, which implies that MODIS data could be used as satellite data source for rice cultivation area estimation, possibly rice growth monitoring and yield forecasting on the regional scale.

  3. Use of Linear Spectral Mixture Model to Estimate Rice Planted Area Based on MODIS Data

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    MODIS (Moderate Resolution Imaging Spectroradiometer) is a key instrument aboard the Terra (EOS AM) and Aqua (EOS PM) satellites.Linear spectral mixture models are applied to MOIDS data for the sub-pixel classification of land covers.Shaoxing county of Zhcjiang Province in China was chosen to be the study site and early rice was selected as the study crop.The derived proportions of land covers from MODIS pixel using linear spectral mixture models were compared with unsupervised classification derived from TM data acquired on the same day,which implies that MODIS data could be used as satellite data source for rice cultivation area estimation,possibly rice growth monitoring and yield forecasting on the regional scale.

  4. A lattice traffic model with consideration of preceding mixture traffic information

    Institute of Scientific and Technical Information of China (English)

    Li Zhi-Peng; Liu Fu-Qiang; Sun Jian

    2011-01-01

    In this paper,the lattice model is presented,incorporating not only site information about preceding cars but also relative currents in front.We derive the stability condition of the extended model by considering a small perturbation around the homogeneous flow solution and find that the improvement in the stability of traffic flow is obtained by taking into account preceding mixture traffic information.Direct simulations also confirm that the traffic jam can be suppressed efficiently by considering the relative currents ahead,just like incorporating site information in front.Moreover,from the nonlinear analysis of the extended models,the preceding mixture traffic information dependence of the propagating kink solutions for traffic jams is obtained by deriving the modified KdV equation near the critical point using the reductive perturbation method.

  5. Lattice Model for water-solute mixtures

    OpenAIRE

    Furlan, A. P.; Almarza, N. G.; M. C. Barbosa

    2016-01-01

    A lattice model for the study of mixtures of associating liquids is proposed. Solvent and solute are modeled by adapting the associating lattice gas (ALG) model. The nature of interaction solute/solvent is controlled by tuning the energy interactions between the patches of ALG model. We have studied three set of parameters, resulting on, hydrophilic, inert and hydrophobic interactions. Extensive Monte Carlo simulations were carried out and the behavior of pure components and the excess proper...

  6. Fluorous Mixture Synthesis of Asymmetric Dendrimers

    Science.gov (United States)

    Jiang, Zhong-Xing; Yu, Yihua Bruce

    2010-01-01

    A divergent fluorous mixture synthesis (FMS) of asymmetric fluorinated dendrimers has been developed. Four generations of fluorinated dendrimers with the same fluorinated moiety were prepared with high efficiency, yield and purity. Comparison of the physicochemical properties of these dendrimers provided valuable information for their application and future optimization. This strategy has not only provided a practical method for the synthesis and purification of dendrimers, but also established the possibility of utilizing the same fluorinated moiety for FMS. PMID:20170088

  7. Nitrocarburising in ammonia-hydrocarbon gas mixtures

    DEFF Research Database (Denmark)

    Pedersen, Hanne; Christiansen, Thomas; Somers, Marcel A. J.

    2010-01-01

    The present work investigates the possibility of nitrocarburising in ammonia-acetylene-hydrogen and ammoniapropene- hydrogen gas mixtures, where unsaturated hydrocarbon gas is the carbon source during nitrocarburising. Consequently, nitrocarburising is carried out in a reducing atmosphere...... microscopy and X-ray diffraction analysis. It is shown that the use of unsaturated hydrocarbon gas in nitrocarburising processes is a viable alternative to traditional nitrocarburising methods....

  8. Nitrocarburizing in ammonia-hydrocarbon gas mixtures

    DEFF Research Database (Denmark)

    Pedersen, Hanne; Christiansen, Thomas; Somers, Marcel A. J.

    2011-01-01

    The present work investigates the possibility of nitrocarburising in ammonia-acetylene-hydrogen and ammonia-propene-hydrogen gas mixtures, where unsaturated hydrocarbon gas is the carbon source during nitrocarburising. Consequently, nitrocarburising is carried out in a reducing atmosphere...... microscopy and X-ray diffraction analysis. It is shown that the use of unsaturated hydrocarbon gas in nitrocarburising processes is a viable alternative to traditional nitrocarburising methods....

  9. Endocrine activity of mycotoxins and mycotoxin mixtures.

    Science.gov (United States)

    Demaegdt, Heidi; Daminet, Britt; Evrard, Annick; Scippo, Marie-Louise; Muller, Marc; Pussemier, Luc; Callebaut, Alfons; Vandermeiren, Karine

    2016-10-01

    Reporter gene assays incorporating nuclear receptors (estrogen, androgen, thyroid β and PPARγ2) have been implemented to assess the endocrine activity of 13 mycotoxins and their mixtures. As expected, zearalenone and its metabolites α-zearalenol and β- zearalenol turned out to have the strongest estrogenic potency (EC50 8,7 10-10 ± 0,8; 3,1 10-11 ± 0,5 and 1,3 10-8 ± 0,3 M respectively). The metabolite of deoxynivalenol, 3-acetyl-deoxynivalenol also had estrogenic activity (EC50 3,8 10-7 ± 1,1 M). Furthermore, most of the mycotoxins (and their mixtures) showed anti-androgenic effects (15-acetyldeoxynivalenol, 3-acetyl-deoxynivalenol and α-zearalenol with potencies within one order of magnitude of that of the reference compound flutamide). In particular, deoxynivalenol and 15-acetyl-deoxynivalenol acted as antagonists for the PPARy2 receptor. When testing mixtures of mycotoxins on the same cell systems, we showed that most of the mixtures reacted as predicted by the concentration addition (CA) theory. Generally, the CA was within the 95% confidence interval of the observed ones, only minor deviations were detected. Although these reporter gene tests cannot be directly extrapolated in vivo, they can be the basis for further research. Especially the additive effects of ZEN and its metabolites are of importance and could have repercussions in vivo.

  10. Method for Predicting Hypergolic Mixture Flammability Limits

    Science.gov (United States)

    2017-02-01

    AFRL-AFOSR-UK-TR-2017-0003 Method for Predicting Hypergolic Mixture Flammability Limits Laurent Catoire Ecole Nat Sup De Techniques Avancees Final...TASK NUMBER 5f.  WORK UNIT NUMBER 7. PERFORMING ORGANIZATION NAME(S) AND ADDRESS(ES) Ecole Nat Sup De Techniques Avancees 828, Boulevard Des Marechaux...provides a mitigation strategy to reduce the risk of failure for the insertion of IL fuel technology into the small satellite market as AFRL/RQRP

  11. Population mixture model for nonlinear telomere dynamics

    Science.gov (United States)

    Itzkovitz, Shalev; Shlush, Liran I.; Gluck, Dan; Skorecki, Karl

    2008-12-01

    Telomeres are DNA repeats protecting chromosomal ends which shorten with each cell division, eventually leading to cessation of cell growth. We present a population mixture model that predicts an exponential decrease in telomere length with time. We analytically solve the dynamics of the telomere length distribution. The model provides an excellent fit to available telomere data and accounts for the previously unexplained observation of telomere elongation following stress and bone marrow transplantation, thereby providing insight into the nature of the telomere clock.

  12. Hierarchical mixture models for assessing fingerprint individuality

    OpenAIRE

    Dass, Sarat C.; Li, Mingfei

    2009-01-01

    The study of fingerprint individuality aims to determine to what extent a fingerprint uniquely identifies an individual. Recent court cases have highlighted the need for measures of fingerprint individuality when a person is identified based on fingerprint evidence. The main challenge in studies of fingerprint individuality is to adequately capture the variability of fingerprint features in a population. In this paper hierarchical mixture models are introduced to infer the extent of individua...

  13. Familial searching on DNA mixtures with dropout.

    Science.gov (United States)

    Slooten, K

    2016-05-01

    Familial searching, the act of searching a database for a relative of an unknown individual whose DNA profile has been obtained, is usually restricted to cases where the DNA profile of that person has been unambiguously determined. Therefore, it is normally applied only with a good quality single source profile as starting point. In this article we investigate the performance of the method if applied to mixtures with and without allelic dropout, when likelihood ratios are computed with a semi-continuous (binary) model. We show that mixtures with dropout do not necessarily perform worse than mixtures without, especially if some separation between the donors is possible due to their different dropout probabilities. The familial searching true and false positive rates of mixed profiles on 15 loci are in some cases better than those of single source profiles on 10 loci. Thus, the information loss due to the fact that the person of interest's DNA has been mixed with that of other, and is affected by dropout, can be less than the loss of information corresponding to having 5 fewer loci available for a single source trace. Profiles typed on 10 autosomal loci are often involved in familial searching casework since many databases, including the Dutch one, in part consist of such profiles. Therefore, from this point of view, there seems to be no objection to extend familial searching to mixed or degraded profiles.

  14. Ethane-xenon mixtures under shock conditions

    Science.gov (United States)

    Flicker, Dawn; Magyar, Rudolph; Root, Seth; Cochrane, Kyle; Mattsson, Thomas

    2015-06-01

    Mixtures of light and heavy elements arise in inertial confinement fusion and planetary science. We present results on the physics of molecular scale mixing through a validation study of equation of state (EOS) properties. Density functional theory molecular dynamics (DFT/QMD) at elevated-temperature and pressure is used to obtain the properties of pure xenon, ethane, and various compressed mixture compositions along their principal Hugoniots. To validate the QMD simulations, we performed high-precision shock compression experiments using Sandia's Z-Machine. A bond tracking analysis of the simulations correlates the sharp rise in the Hugoniot curve with completion of dissociation in ethane. DFT-based simulation results compare well with experimental data and are used to provide insight into the dissociation as a function of mixture composition. Interestingly, we find that the compression ratio for complete dissociation is similar for ethane, Xe-ethane, polymethyl-pentene, and polystyrene, suggesting that a limiting compression exists for C-C bonded systems. Sandia National Laboratories is a multi-program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Company, Security Administration under contract DE-AC04-94AL85000.

  15. Crowding in polymer-nanoparticle mixtures.

    Science.gov (United States)

    Denton, Alan R

    2014-01-01

    The cell nucleus is a highly crowded environment, filled with a multicomponent, polydisperse mixture of biopolymers and nuclear bodies dispersed in a viscous solvent. With volume fractions approaching 20%, excluded-volume interactions play a key role in determining the structure, dynamics, and function of macromolecules in vivo. Under such constraints, the ensembles of macromolecular conformations can differ substantially from those prevailing in dilute solutions. Crowding thus can affect protein and RNA folding, conformational stability, and reaction kinetics, as well as phase stability of macromolecular mixtures. From the perspective of soft matter physics, this chapter reviews recent studies on crowding in polymer-nanoparticle mixtures, seeking to demonstrate the utility of simple physical models for addressing challenging issues in cell biology. The focus is on applications of free-volume theory and Monte Carlo simulation, based on geometrical models of polymers as fluctuating spheres or ellipsoids. Ideal polymer coils respond to hard-sphere crowding agents by compactifying, reducing their radius of gyration, and becoming more spherical. At sufficiently high concentrations, polymers and crowders phase-separate. The goal of this review is to identify universal principles governing macromolecular crowding and to establish a general framework for future explorations of more realistic models that may include nonsteric (e.g., electrostatic) interactions. © 2014 Elsevier Inc. All rights reserved.

  16. Tandem mass spectrometry: analysis of complex mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Singleton, K.E.

    1985-01-01

    Applications of tandem mass spectrometry (MS/MS) for the analysis of complex mixtures results in increased specificity and selectivity by using a variety of reagent gases in both negative and positive ion modes. Natural isotopic abundance ratios were examined in both simple and complex mixtures using parent, daughter and neutral loss scans. MS/MS was also used to discover new compounds. Daughter scans were used to identify seven new alkaloids in a cactus species. Three of these alkaloids were novel compounds, and included the first simple, fully aromatic isoquinoline alkaloids reported in Cactaceae. MS/MS was used to characterize the chemical reaction products of coal in studies designed to probe its macromolecular structure. Negative ion chemical ionization was utilized to study reaction products resulting from the oxidation of coal. Possible structural units in the precursor coal were predicted based on the reaction products identified, aliphatic and aromatic acids and their anhydrides. The MS/MS method was also used to characterize reaction products resulting from coal liquefaction and/or extraction. These studies illustrate the types of problems for which MS/MS is useful. Emphasis has been placed on characterization of complex mixtures by selecting experimental parameters which enhance the information obtained. The value of using MS/MS in conjunction with other analytical techniques as well as the chemical pretreatment is demonstrated.

  17. Confusion of concepts in mixture toxicology.

    Science.gov (United States)

    Könemann, W H; Pieters, M N

    1996-01-01

    Regulatory limit values are generally set for single compounds. However, humans are exposed both simultaneously and sequentially to a wide variety of compounds. Some concepts on mixture toxicology are discussed in this introduction to the European Conference on Combination Toxicology. Studies on mixtures are often accompanied by statements about the type of combined action, which can be, for example, additive, synergistic or antagonistic. Unfortunately, comparison of results is hardly possible for various reasons. First, the terminology for indicating combined action is far from consistent. Bearing this in mind, researchers should be explicit in the definitions of terms. Secondly, depending on the model, different conclusions may be drawn from the same results. It is therefore important to provide clear definitions of the null hypothesis. Thirdly, adequate statistical methods should be used for testing the null hypothesis. In the past, many mixtures studies either used no statistics or used statistics incorrectly. Last, but not least, the study should be designed in such a way that it should be possible to obtain clear answers. In this introduction, it is stressed that environmental toxicologists should focus on the low-dose region of the dose-effect curves. It appears that interactions are less plausible at low doses. Dose additivity, however, cannot be excluded.

  18. Mixture risk assessment: a case study of Monsanto experiences.

    Science.gov (United States)

    Nair, R S; Dudek, B R; Grothe, D R; Johannsen, F R; Lamb, I C; Martens, M A; Sherman, J H; Stevens, M W

    1996-01-01

    Monsanto employs several pragmatic approaches for evaluating the toxicity of mixtures. These approaches are similar to those recommended by many national and international agencies. When conducting hazard and risk assessments, priority is always given to using data collected directly on the mixture of concern. To provide an example of the first tier of evaluation, actual data on acute respiratory irritation studies on mixtures were evaluated to determine whether the principle of additivity was applicable to the mixture evaluated. If actual data on the mixture are unavailable, extrapolation across similar mixtures is considered. Because many formulations are quite similar in composition, the toxicity data from one mixture can be extended to a closely related mixture in a scientifically justifiable manner. An example of a family of products where such extrapolations have been made is presented to exemplify this second approach. Lastly, if data on similar mixtures are unavailable, data on component fractions are used to predict the toxicity of the mixture. In this third approach, process knowledge and scientific judgement are used to determine how the known toxicological properties of the individual fractions affect toxicity of the mixture. Three examples of plant effluents where toxicological data on fractions were used to predict the toxicity of the mixture are discussed. The results of the analysis are used to discuss the predictive value of each of the above mentioned toxicological approaches for evaluating chemical mixtures.

  19. Comparison of the Noise Robustness of FVC Retrieval Algorithms Based on Linear Mixture Models

    OpenAIRE

    Hiroki Yoshioka; Kenta Obata

    2011-01-01

    The fraction of vegetation cover (FVC) is often estimated by unmixing a linear mixture model (LMM) to assess the horizontal spread of vegetation within a pixel based on a remotely sensed reflectance spectrum. The LMM-based algorithm produces results that can vary to a certain degree, depending on the model assumptions. For example, the robustness of the results depends on the presence of errors in the measured reflectance spectra. The objective of this study was to derive a factor that could ...

  20. On sufficient stability conditions of the Couette — Poiseuille flow of monodisperse mixture

    Science.gov (United States)

    Popov, D. I.; Sagalakov, A. M.; Nikitenko, N. G.

    2011-06-01

    The stability of the Couette — Poiseuille flow of a monodisperse mixture is considered. Sufficient stability conditions are derived. Results of the computation of the spectrum are presented. A considerable stabilization of the flow with particles admixture to small disturbances is observed. It is found that the regions of instability generation may have complex geometry. The influence of the main velocity profile and admixture parameters on the stability conditions is considered.

  1. Steady detonation waves via the Boltzmann equation for a reacting mixture

    CERN Document Server

    Conforto, F; Schürrer, F; Ziegler, I

    2003-01-01

    Based on the Boltzmann equation, the detonation problem is dealt with on a mesoscopic level. The model is based on the assumption that ahead of a shock an explosive gas mixture is in meta stable equilibrium. Starting from the Von Neumann point the chemical reaction, initiated by the pressure jump, proceeds until the chemical equilibrium is reached. Numerical solutions of the derived macroscopic equations as well as the corresponding Hugoniot diagrams which reveal the physical relevance of the mathematical model are provided.

  2. Phylogenetic Mixtures: Concentration of Measure in the Large-Tree Limit

    CERN Document Server

    Mossel, Elchanan

    2011-01-01

    The reconstruction of phylogenies from DNA or protein sequences is a major task of computational evolutionary biology. Common phenomena, notably variations in mutation rates across genomes and incongruences between gene lineage histories, often make it necessary to model molecular data as originating from a mixtureof phylogenies. Such mixed models play an increasingly important role in practice. Using concentration of measure techniques, we show that mixtures of large trees are typically identifiable. We also derive sequence-length requirements for high-probability reconstruction.

  3. Ozo-Dyes mixture degradation in a fixed bed biofilm reactor packed with volcanic porous rock

    Energy Technology Data Exchange (ETDEWEB)

    Contreras-Blancas, E.; Cobos-Vasconcelos, D. de los; Juarez-Ramirez, C.; Poggi-Varaldo, H. M.; Ruiz-Ordaz, N.; Galindez-Mayer, J.

    2009-07-01

    Textile industries discharge great amounts of dyes and dyeing-process auxiliaries, which pollute streams and water bodies. Several dyes, especially the ones containing the azo group, can cause harmful effects to different organisms including humans. Through bacterial and mammalian tests, azo dyes or their derived aromatic amines have shown cell genotoxicity. The purpose of this work was to evaluate the effect of air flow rate on azo-dyes mixture biodegradation by a microbial community immobilized in a packed bed reactor. (Author)

  4. Metastable sound speed in gas-liquid mixtures

    Science.gov (United States)

    Bursik, J. W.; Hall, R. M.

    1979-01-01

    A new method of calculating speed of sound for two-phase flow is presented. The new equation assumes no phase change during the propagation of an acoustic disturbance and assumes that only the total entropy of the mixture remains constant during the process. The new equation predicts single-phase values for the speed of sound in the limit of all gas or all liquid and agrees with available two-phase, air-water sound speed data. Other expressions used in the two-phase flow literature for calculating two-phase, metastable sound speed are reviewed and discussed. Comparisons are made between the new expression and several of the previous expressions -- most notably a triply isentropic equation as used, a triply isentropic equation as used, among others, by Karplus and by Wallis. Appropriate differences are pointed out and a thermodynamic criterion is derived which must be satisfied in order for the triply isentropic expression to be thermodynamically consistent. This criterion is not satisfied for the cases examined, which included two-phase nitrogen, air-water, two-phase parahydrogen, and steam-water. Consequently, the new equation derived is found to be superior to the other equations reviewed.

  5. A general mixture model and its application to coastal sandbar migration simulation

    Science.gov (United States)

    Liang, Lixin; Yu, Xiping

    2017-04-01

    A mixture model for general description of sediment laden flows is developed and then applied to coastal sandbar migration simulation. Firstly the mixture model is derived based on the Eulerian-Eulerian approach of the complete two-phase flow theory. The basic equations of the model include the mass and momentum conservation equations for the water-sediment mixture and the continuity equation for sediment concentration. The turbulent motion of the mixture is formulated for the fluid and the particles respectively. A modified k-ɛ model is used to describe the fluid turbulence while an algebraic model is adopted for the particles. A general formulation for the relative velocity between the two phases in sediment laden flows, which is derived by manipulating the momentum equations of the enhanced two-phase flow model, is incorporated into the mixture model. A finite difference method based on SMAC scheme is utilized for numerical solutions. The model is validated by suspended sediment motion in steady open channel flows, both in equilibrium and non-equilibrium state, and in oscillatory flows as well. The computed sediment concentrations, horizontal velocity and turbulence kinetic energy of the mixture are all shown to be in good agreement with experimental data. The mixture model is then applied to the study of sediment suspension and sandbar migration in surf zones under a vertical 2D framework. The VOF method for the description of water-air free surface and topography reaction model is coupled. The bed load transport rate and suspended load entrainment rate are all decided by the sea bed shear stress, which is obtained from the boundary layer resolved mixture model. The simulation results indicated that, under small amplitude regular waves, erosion occurred on the sandbar slope against the wave propagation direction, while deposition dominated on the slope towards wave propagation, indicating an onshore migration tendency. The computation results also shows that

  6. Physical Compatibility of Propofol-Sufentanil Mixtures.

    Science.gov (United States)

    Zbytovská, Jarmila; Gallusová, Jana; Vidlářová, Lucie; Procházková, Kamila; Šimek, Jan; Štěpánek, František

    2017-03-01

    Combined infusions of propofol and sufentanil preparations are frequently used in clinical practice to induce anesthesia and analgesia. However, the stability of propofol emulsions can be affected by dilution with another preparation, sometimes leading to particle coalescence and enlargement. Such unwanted effects can lead to fat embolism syndrome after intravenous application. This study describes the physical stability of 5 commercially available propofol preparations mixed with sufentanil citrate solutions. Two common markers of emulsion stability were used in this study; namely, the zeta potential and size distribution of the emulsion droplets. Both were measured using dynamic light scattering. The data for the pure propofol preparations and their mixtures with sufentanil citrate solution were compared. The absolute value of zeta potential decreased in 4 of the 5 propofol preparations after they had been mixed with sufentanil citrate. This effect indicates a lowering of repulsive interactions between the emulsion droplets. Although this phenomenon tends to cause agglomeration, none of the studied mixtures displayed a substantial increase in droplet size within 24 hours of blending. However, our long-term stability study revealed the instability of some of the propofol-sufentanil samples. Two of the 5 studied mixtures displayed a continual increase in particle size. The same 2 preparations showed the greatest reductions in the absolute value of zeta potential, thereby confirming the correlation of both measurement methods. The increase in particle size was more distinct in the samples stored at higher temperatures and with higher sufentanil concentrations. To ensure the microbial stability of an emulsion infusion preparation, clinical regulations require that such preparations should be applied to patients within 12 hours of opening. In this respect, we can confirm that during this period, none of the studied propofol-sufentanil mixtures displayed any physical

  7. Separation of gas mixtures by supported complexes

    Energy Technology Data Exchange (ETDEWEB)

    Nelson, D.A.; Lilga, M.A.; Hallen, R.T.; Lyke, S.E.

    1986-08-01

    The goal of this program is to determine the feasibility of solvent-dissolved coordination complexes for the separation of gas mixtures under bench-scale conditions. In particular, mixtures such as low-Btu gas are examined for CO and H/sub 2/ separation. Two complexes, Pd/sub 2/(dpm)/sub 2/Br/sub 2/ and Ru(CO)/sub 2/(PPh/sub 3/)/sub 3/, were examined in a bench-scale apparatus for the separation of binary (CO-N/sub 2/ or H/sub 2/-N/sub 2/) and quinary (H/sub 2/, CO, CO/sub 2/, CH/sub 4/, and N/sub 2/) mixtures. The separation of CO-N/sub 2/ was enhanced by the presence of the palladium complex in the 1,1,2-trichloroethane (TCE) solvent, especially at high gas and low liquid rates. The five-component gas mixture separation with the palladium complex in TCE provided quite unexpected results based on physical solubility and chemical coordination. The complex retained CO, while the solvent retained CO/sub 2/, CH/sub 4/, and N/sub 2/ to varying degrees. This allowed the hydrogen content to be enhanced due to its low solubility in TCE and inertness to the complex. Thus, a one-step, hydrogen separation can be achieved from gas mixtures with compositions similar to that of oxygen-blown coal gas. A preliminary economic evaluation of hydrogen separation was made for a system based on the palladium complex. The palladium system has a separation cost of 50 to 60 cents/MSCF with an assumed capital investment of $1.60/MSCF of annual capacity charged at 30% per year. This assumes a 3 to 4 year life for the complex. Starting with a 90% hydrogen feed, PSA separation costs are in the range of 30 to 50 cents/MSCF. The ruthenium complex was not as successful for hydrogen or carbon monoxide separation due to unfavorable kinetics. The palladium complex was found to strip hydrogen gas from H/sub 2/S. The complex could be regenerated with mild oxidants which removed the sulfur as SO/sub 2/. 24 refs., 26 figs., 10 tabs.

  8. Mixtures as a fungicide resistance management tactic.

    Science.gov (United States)

    van den Bosch, Frank; Paveley, Neil; van den Berg, Femke; Hobbelen, Peter; Oliver, Richard

    2014-12-01

    We have reviewed the experimental and modeling evidence on the use of mixtures of fungicides of differing modes of action as a resistance management tactic. The evidence supports the following conclusions. 1. Adding a mixing partner to a fungicide that is at-risk of resistance (without lowering the dose of the at-risk fungicide) reduces the rate of selection for fungicide resistance. This holds for the use of mixing partner fungicides that have either multi-site or single-site modes of action. The resulting predicted increase in the effective life of the at-risk fungicide can be large enough to be of practical relevance. The more effective the mixing partner (due to inherent activity and/or dose), the larger the reduction in selection and the larger the increase in effective life of the at-risk fungicide. 2. Adding a mixing partner while lowering the dose of the at-risk fungicide reduces the selection for fungicide resistance, without compromising effective disease control. The very few studies existing suggest that the reduction in selection is more sensitive to lowering the dose of the at-risk fungicide than to increasing the dose of the mixing partner. 3. Although there are very few studies, the existing evidence suggests that mixing two at-risk fungicides is also a useful resistance management tactic. The aspects that have received too little attention to draw generic conclusions about the effectiveness of fungicide mixtures as resistance management strategies are as follows: (i) the relative effect of the dose of the two mixing partners on selection for fungicide resistance, (ii) the effect of mixing on the effective life of a fungicide (the time from introduction of the fungicide mode of action to the time point where the fungicide can no longer maintain effective disease control), (iii) polygenically determined resistance, (iv) mixtures of two at-risk fungicides, (v) the emergence phase of resistance evolution and the effects of mixtures during this phase

  9. Investigation of rheological properties of mixtures of soft ice cream

    Directory of Open Access Journals (Sweden)

    L. V. Golubeva

    2012-01-01

    Full Text Available The paper presents the study of the rheological properties of multicomponent mixtures for soft ice cream enriched with various stabilizers to facilitate evaluation and selection of the optimal mixture.

  10. Methods for Assessing Curvature and Interaction in Mixture Experiments

    Energy Technology Data Exchange (ETDEWEB)

    Piepel, Gregory F.(BATTELLE (PACIFIC NW LAB)); Hicks, Ruel D.(ASSOC WESTERN UNIVERSITY); Szychowski, Jeffrey M.(ASSOC WESTERN UNIVERSITY); Loeppky, Jason L.(ASSOC WESTERN UNIVERSITY)

    2002-05-01

    The terms curvature and interaction traditionally are not defined or used in the context of mixture experiments because curvature and interaction effects are partially confounded due to the mixture constrain that the component proportions sum to 1.

  11. Mixture Density Mercer Kernels: A Method to Learn Kernels

    Data.gov (United States)

    National Aeronautics and Space Administration — This paper presents a method of generating Mercer Kernels from an ensemble of probabilistic mixture models, where each mixture model is generated from a Bayesian...

  12. Optimal (Solvent) Mixture Design through a Decomposition Based CAMD methodology

    DEFF Research Database (Denmark)

    Achenie, L.; Karunanithi, Arunprakash T.; Gani, Rafiqul

    2004-01-01

    Computer Aided Molecular/Mixture design (CAMD) is one of the most promising techniques for solvent design and selection. A decomposition based CAMD methodology has been formulated where the mixture design problem is solved as a series of molecular and mixture design sub-problems. This approach is...... is able to overcome most of the difficulties associated with the solution of mixture design problems. The new methodology has been illustrated with the help of a case study involving the design of solvent-anti solvent binary mixtures for crystallization of Ibuprofen.......Computer Aided Molecular/Mixture design (CAMD) is one of the most promising techniques for solvent design and selection. A decomposition based CAMD methodology has been formulated where the mixture design problem is solved as a series of molecular and mixture design sub-problems. This approach...

  13. Bending stiffness depends on curvature of ternary lipid mixture tubular membranes.

    Science.gov (United States)

    Tian, Aiwei; Capraro, Benjamin R; Esposito, Cinzia; Baumgart, Tobias

    2009-09-16

    Lipid and protein sorting and trafficking in intracellular pathways maintain cellular function and contribute to organelle homeostasis. Biophysical aspects of membrane shape coupled to sorting have recently received increasing attention. Here we determine membrane tube bending stiffness through measurements of tube radii, and demonstrate that the stiffness of ternary lipid mixtures depends on membrane curvature for a large range of lipid compositions. This observation indicates amplification by curvature of cooperative lipid demixing. We show that curvature-induced demixing increases upon approaching the critical region of a ternary lipid mixture, with qualitative differences along two roughly orthogonal compositional trajectories. Adapting a thermodynamic theory earlier developed by M. Kozlov, we derive an expression that shows the renormalized bending stiffness of an amphiphile mixture membrane tube in contact with a flat reservoir to be a quadratic function of curvature. In this analytical model, the degree of sorting is determined by the ratio of two thermodynamic derivatives. These derivatives are individually interpreted as a driving force and a resistance to curvature sorting. We experimentally show this ratio to vary with composition, and compare the model to sorting by spontaneous curvature. Our results are likely to be relevant to the molecular sorting of membrane components in vivo.

  14. Heteroscedastic nonlinear regression models based on scale mixtures of skew-normal distributions.

    Science.gov (United States)

    Lachos, Victor H; Bandyopadhyay, Dipankar; Garay, Aldo M

    2011-08-01

    An extension of some standard likelihood based procedures to heteroscedastic nonlinear regression models under scale mixtures of skew-normal (SMSN) distributions is developed. We derive a simple EM-type algorithm for iteratively computing maximum likelihood (ML) estimates and the observed information matrix is derived analytically. Simulation studies demonstrate the robustness of this flexible class against outlying and influential observations, as well as nice asymptotic properties of the proposed EM-type ML estimates. Finally, the methodology is illustrated using an ultrasonic calibration data.

  15. Investigation of a Gamma model for mixture STR samples

    DEFF Research Database (Denmark)

    Christensen, Susanne; Bøttcher, Susanne Gammelgaard; Lauritzen, Steffen L.

    The behaviour of PCR Amplification Kit, when used for mixture STR samples, is investigated. A model based on the Gamma distribution is fitted to the amplifier output for constructed mixtures, and the assumptions of the model is evaluated via residual analysis.......The behaviour of PCR Amplification Kit, when used for mixture STR samples, is investigated. A model based on the Gamma distribution is fitted to the amplifier output for constructed mixtures, and the assumptions of the model is evaluated via residual analysis....

  16. Quantum phases of Fermi-Fermi mixtures in optical lattices

    OpenAIRE

    Iskin, M.; de Melo, C. A. R. Sa

    2007-01-01

    The ground state phase diagram of Fermi-Fermi mixtures in optical lattices is analyzed as a function of interaction strength, population imbalance, filling fraction and tunneling parameters. It is shown that population imbalanced Fermi-Fermi mixtures reduce to strongly interacting Bose-Fermi mixtures in the molecular limit, in sharp contrast to homogeneous or harmonically trapped systems where the resulting Bose-Fermi mixture is weakly interacting. Furthermore, insulating phases are found in ...

  17. Continuous mixtures with bathtub-shaped failure rates

    OpenAIRE

    Block, Henry W.; LI, YULIN; Savits, Thomas H.; Wang, Jie

    2008-01-01

    The failure rate of a mixture of even the most standard distributions used in reliability can have a complicated shape. However, failure rates of mixtures of two carefully selected distributions will have the well-known bathtub shape. Here we show that mixtures of whole families of distribtions can have a bathtub-shaped failure rate.

  18. Lessons learned in managing alfalfa-grass mixtures

    Science.gov (United States)

    Grass-alfalfa mixtures have a number of benefits that make them attractive to producers. However, they can be problematic to establish and maintain. Research programs have made progress in understanding the benefits and challenges of alfalfa-grass mixtures. Mixtures may have greater winter survival ...

  19. 40 CFR 721.5769 - Mixture of nitrated alkylated phenols.

    Science.gov (United States)

    2010-07-01

    ... 40 Protection of Environment 30 2010-07-01 2010-07-01 false Mixture of nitrated alkylated phenols... Substances § 721.5769 Mixture of nitrated alkylated phenols. (a) Chemical substance and significant new uses subject to reporting. (1) The chemical substance identified as a mixture of nitrated alkylated...

  20. 21 CFR 864.8625 - Hematology quality control mixture.

    Science.gov (United States)

    2010-04-01

    ... 21 Food and Drugs 8 2010-04-01 2010-04-01 false Hematology quality control mixture. 864.8625 Section 864.8625 Food and Drugs FOOD AND DRUG ADMINISTRATION, DEPARTMENT OF HEALTH AND HUMAN SERVICES... quality control mixture. (a) Identification. A hematology quality control mixture is a device used...

  1. TEMPERATURE INFLUENCE ON PHASE STABILITY OF ETHANOL-GASOLINE MIXTURES

    Directory of Open Access Journals (Sweden)

    Valerian Cerempei

    2011-06-01

    Full Text Available The article investigates phase stability of ethanol-gasoline mixtures depending on their composition, water concentration in ethanol and ethanol-gasoline mixture and temperature. There have been determined the perfect functioning conditions of spark ignition engines fueled with ethanol-gasoline mixtures.

  2. 46 CFR 154.1735 - Methyl acetylene-propadiene mixture.

    Science.gov (United States)

    2010-10-01

    ... 46 Shipping 5 2010-10-01 2010-10-01 false Methyl acetylene-propadiene mixture. 154.1735 Section... Operating Requirements § 154.1735 Methyl acetylene-propadiene mixture. (a) The composition of the methyl acetylene-propadiene mixture at loading must be within the following limits or specially approved by...

  3. Generalized transport coefficients for inelastic Maxwell mixtures under shear flow

    Science.gov (United States)

    Garzó, Vicente; Trizac, Emmanuel

    2015-11-01

    The Boltzmann equation framework for inelastic Maxwell models is considered to determine the transport coefficients associated with the mass, momentum, and heat fluxes of a granular binary mixture in spatially inhomogeneous states close to the simple shear flow. The Boltzmann equation is solved by means of a Chapman-Enskog-type expansion around the (local) shear flow distributions fr(0 ) for each species that retain all the hydrodynamic orders in the shear rate. Due to the anisotropy induced by the shear flow, tensorial quantities are required to describe the transport processes instead of the conventional scalar coefficients. These tensors are given in terms of the solutions of a set of coupled equations, which can be analytically solved as functions of the shear rate a , the coefficients of restitution αr s, and the parameters of the mixture (masses, diameters, and composition). Since the reference distribution functions fr(0 ) apply for arbitrary values of the shear rate and are not restricted to weak dissipation, the corresponding generalized coefficients turn out to be nonlinear functions of both a and αr s. The dependence of the relevant elements of the three diffusion tensors on both the shear rate and dissipation is illustrated in the tracer limit case, the results showing that the deviation of the generalized transport coefficients from their forms for vanishing shear rates is in general significant. A comparison with the previous results obtained analytically for inelastic hard spheres by using Grad's moment method is carried out, showing a good agreement over a wide range of values for the coefficients of restitution. Finally, as an application of the theoretical expressions derived here for the transport coefficients, thermal diffusion segregation of an intruder immersed in a granular gas is also studied.

  4. Process to prepare stable trifluorostyrene containing compounds grafted to base polymers using a solvent/water mixture

    Science.gov (United States)

    Roelofs, Mark Gerrit; Yang, Zhen-Yu; Han, Amy Qi

    2010-06-15

    A fluorinated ion exchange polymer is prepared by grafting at least one grafting monomer derived from trifluorostyrene on to at least one base polymer in a organic solvent/water mixture. These ion exchange polymers are useful in preparing catalyst coated membranes and membrane electrode assemblies used in fuel cells.

  5. Integrated phospholipidomics and transcriptomics analysis of Saccharomyces cerevisiae with enhanced tolerance to a mixture of acetic acid, furfural, and phenol

    Science.gov (United States)

    A mixture of acetic acid, furfural and phenol (AFP), three representative lignocellulose derived inhibitors, significantly inhibited the growth and bioethanol production of Saccharomyces cerevisiae. In order to uncover mechanisms behind the enhanced tolerance of an inhibitor-tolerant S.cerevisiae s...

  6. Mixture of a seismicity model based on the rate-and-state friction and ETAS model

    Science.gov (United States)

    Iwata, T.

    2015-12-01

    Currently the ETAS model [Ogata, 1988, JASA] is considered to be a standard model of seismicity. However, because the ETAS model is a purely statistical one, the physics-based seismicity model derived from the rate-and-state friction (hereafter referred to as Dieterich model) [Dieterich, 1994, JGR] is frequently examined. However, the original version of the Dieterich model has several problems in the application to real earthquake sequences and therefore modifications have been conducted in previous studies. Iwata [2015, Pageoph] is one of such studies and shows that the Dieterich model is significantly improved as a result of the inclusion of the effect of secondary aftershocks (i.e., aftershocks caused by previous aftershocks). However, still the performance of the ETAS model is superior to that of the improved Dieterich model. For further improvement, the mixture of the Dieterich and ETAS models is examined in this study. To achieve the mixture, the seismicity rate is represented as a sum of the ETAS and Dieterich models of which weights are given as k and 1-k, respectively. This mixture model is applied to the aftershock sequences of the 1995 Kobe and 2004 Mid-Niigata sequences which have been analyzed in Iwata [2015]. Additionally, the sequence of the Matsushiro earthquake swarm in central Japan 1965-1970 is also analyzed. The value of k and parameters of the ETAS and Dieterich models are estimated by means of the maximum likelihood method, and the model performances are assessed on the basis of AIC. For the two aftershock sequences, the AIC values of the ETAS model are around 3-9 smaller (i.e., better) than those of the mixture model. On the contrary, for the Matsushiro swarm, the AIC value of the mixture model is 5.8 smaller than that of the ETAS model, indicating that the mixture of the two models results in significant improvement of the seismicity model.

  7. "Hot ice and wondrous strange snow": three-phase mixtures or something more?

    Science.gov (United States)

    Morris, E. M.

    2012-12-01

    Over the 40 years since John Nye and his colleagues studied regelation and the thermodynamics of water inclusions in polycrystalline ice, physics-based models of mixtures of ice, water and water vapour have become widely-used in glaciology. Such models have been developed, for example, to predict snowmelt and avalanches, to understand the movement of impurities in snow and ice cores, to estimate densification at the surface of polar ice sheets and to help interpret satellite data. The basis for mixture theory models is the concept that each volume of the mixture contains an abundance of all the constituents dispersed within it. In other words the model equations describe properties averaged over a scale which is many times larger than the size of each constituent - the grain size in snow, the inclusion size in temperate ice and so on. All thermo-mechanical models developed so far make simplifying assumptions, sometimes simply to limit the time required for computation, as for example in the snow models used in climate models, but also because all the necessary constitutive relations required for a full thermo-mechanical treatment are not available. Deriving suitable constitutive laws for such a complex, sensitive material has vexed experimentalists and challenged the most determined of mathematical physicists. Nevertheless progress has been made. New measurement techniques, for example the non-destructive measurement of snow density using neutron-scattering and the determination of glacier ice water content using radar, provide better validation data, which can expose weaknesses in the model equations. In the future, we can hope that scaling-up from models of processes on the microstructure scale will provide a solid theoretical foundation for new mixture-scale constitutive relations. For many glaciological problems the mixture-theory approach is the only practical option. The challenge is to ensure that the complex behaviour of the material is well-represented and

  8. Bio-solid-phase extraction/tandem mass spectrometry for identification of bioactive compounds in mixtures.

    Science.gov (United States)

    Forsberg, Erica M; Brennan, John D

    2014-08-19

    We describe a two-step column-based bioassay method with tandem mass spectrometric detection for rapid identification of bioactive species in mixtures. The first step uses an immobilized enzyme reactor (IMER) column interfaced to an electrospray ionization mass spectrometer (ESI-MS) to identify mixtures containing bioactive compounds (i.e., enzyme inhibitors), while the second step uses bioselective solid-phase extraction (bioSPE) columns to isolate compounds from "hit" mixtures, which are then identified online by data-dependent ESI-MS. IMER columns were prepared by entrapment of adenosine deaminase (ADA) into sol-gel derived monolithic silica columns, and used to perform a primary IMER screen of mixtures prepared from a bioactive library, which resulted in four apparent hit compounds. Such columns did not provide sufficient binding site density to allow bioSPE, and thus a new column format was developed using ADA that was covalently immobilized to monolithic silica capillary columns, providing ∼500-fold more protein binding sites than were present in columns containing entrapped proteins. Using the covalently linked ADA columns, bioactive mixtures identified by IMER were infused until a maximum total ion current was achieved, followed by washing with a buffer to remove unbound compounds. A harsh wash with 3% acetic acid eluted the strongly bound ligands and the resulting peak triggered data dependent MS/MS to identify the ligand, showing that two of the apparent hits were true ADA inhibitors and demonstrating the ability of this method to rapidly identify bioactive compounds in mixtures.

  9. [Comparison of two spectral mixture analysis models].

    Science.gov (United States)

    Wang, Qin-Jun; Lin, Qi-Zhong; Li, Ming-Xiao; Wang, Li-Ming

    2009-10-01

    A spectral mixture analysis experiment was designed to compare the spectral unmixing effects of linear spectral mixture analysis (LSMA) and constraint linear spectral mixture analysis (CLSMA). In the experiment, red, green, blue and yellow colors were printed on a coarse album as four end members. Thirty nine mixed samples were made according to each end member's different percent in one pixel. Then, field spectrometer was located on the top of the mixed samples' center to measure spectrum one by one. Inversion percent of each end member in the pixel was extracted using LSMA and CLSMA models. Finally, normalized mean squared error was calculated between inversion and real percent to compare the two models' effects on spectral unmixing. Results from experiment showed that the total error of LSMA was 0.30087 and that of CLSMA was 0.37552 when using all bands in the spectrum. Therefore, LSMA was 0.075 less than that of CLSMA when the whole bands of four end members' spectra were used. On the other hand, the total error of LSMA was 0.28095 and that of CLSMA was 0.29805 after band selection. So, LSMA was 0.017 less than that of CLSMA when bands selection was performed. Therefore, whether all or selected bands were used, the accuracy of LSMA was better than that of CLSMA because during the process of spectrum measurement, errors caused by instrument or human were introduced into the model, leading to that the measured data could not mean the strict requirement of CLSMA and therefore reduced its accuracy: Furthermore, the total error of LSMA using selected bands was 0.02 less than that using the whole bands. The total error of CLSMA using selected bands was 0.077 less than that using the whole bands. So, in the same model, spectral unmixing using selected bands to reduce the correlation of end members' spectra was superior to that using the whole bands.

  10. Flows and chemical reactions in heterogeneous mixtures

    CERN Document Server

    Prud'homme, Roger

    2014-01-01

    This book - a sequel of previous publications 'Flows and Chemical Reactions' and 'Chemical Reactions in Flows and Homogeneous Mixtures' - is devoted to flows with chemical reactions in heterogeneous environments.  Heterogeneous media in this volume include interfaces and lines. They may be the site of radiation. Each type of flow is the subject of a chapter in this volume. We consider first, in Chapter 1, the question of the generation of environments biphasic individuals: dusty gas, mist, bubble flow.  Chapter 2 is devoted to the study at the mesoscopic scale: particle-fluid exchange of mom

  11. Temperature relaxation in dense plasma mixtures

    Science.gov (United States)

    Faussurier, Gérald; Blancard, Christophe

    2016-09-01

    We present a model to calculate temperature-relaxation rates in dense plasma mixtures. The electron-ion relaxation rates are calculated using an average-atom model and the ion-ion relaxation rates by the Landau-Spitzer approach. This method allows the study of the temperature relaxation in many-temperature electron-ion and ion-ion systems such as those encountered in inertial confinement fusion simulations. It is of interest for general nonequilibrium thermodynamics dealing with energy flows between various systems and should find broad use in present high energy density experiments.

  12. Gaussian mixture model of heart rate variability.

    Directory of Open Access Journals (Sweden)

    Tommaso Costa

    Full Text Available Heart rate variability (HRV is an important measure of sympathetic and parasympathetic functions of the autonomic nervous system and a key indicator of cardiovascular condition. This paper proposes a novel method to investigate HRV, namely by modelling it as a linear combination of Gaussians. Results show that three Gaussians are enough to describe the stationary statistics of heart variability and to provide a straightforward interpretation of the HRV power spectrum. Comparisons have been made also with synthetic data generated from different physiologically based models showing the plausibility of the Gaussian mixture parameters.

  13. Spectrometric mixture analysis: An unexpected wrinkle

    Indian Academy of Sciences (India)

    Robert De Levie

    2009-09-01

    The spectrometric analysis of a mixture of two chemically and spectroscopically similar compounds is illustrated for the simultaneous spectrometric determination of caffeine and theobromine, the primary stimulants in coffee and tea, based on their ultraviolet absorbances. Their analysis indicates that such measurements may need an unexpectedly high precision to yield accurate answers, because of an artifact of inverse cancellation, in which a small noise or drift signal is misinterpreted in terms of a concentration difference. The computed sum of the concentrations is not affected.

  14. Bayesian mixture models for partially verified data

    DEFF Research Database (Denmark)

    Kostoulas, Polychronis; Browne, William J.; Nielsen, Søren Saxmose;

    2013-01-01

    for some individuals, in order to minimize this loss in the discriminatory power. The distribution of the continuous antibody response against MAP has been obtained for healthy, MAP-infected and MAP-infectious cows of different age groups. The overall power of the milk-ELISA to discriminate between healthy......Bayesian mixture models can be used to discriminate between the distributions of continuous test responses for different infection stages. These models are particularly useful in case of chronic infections with a long latent period, like Mycobacterium avium subsp. paratuberculosis (MAP) infection...

  15. Two-microphone Separation of Speech Mixtures

    DEFF Research Database (Denmark)

    2006-01-01

    of Speech Mixtures," 2006, submited for journal publication. See also, [2] Michael Syskind Pedersen, DeLiang Wang, Jan Larsen and Ulrik Kjems: "Overcomplete Blind Source Separation by Combining ICA and Binary Time-Frequency Masking," in proceedings of IEEE International workshop on Machine Learning......In this demonstration we show the separation of 3-7 mixed speech sources based on information from two microphones. Separation with background noise is demonstrated too. The algorithms are described in 1] Michael Syskind Pedersen, DeLiang Wang, Jan Larsen and Ulrik Kjems: "Two-microphone Separation...

  16. Video compressive sensing using Gaussian mixture models.

    Science.gov (United States)

    Yang, Jianbo; Yuan, Xin; Liao, Xuejun; Llull, Patrick; Brady, David J; Sapiro, Guillermo; Carin, Lawrence

    2014-11-01

    A Gaussian mixture model (GMM)-based algorithm is proposed for video reconstruction from temporally compressed video measurements. The GMM is used to model spatio-temporal video patches, and the reconstruction can be efficiently computed based on analytic expressions. The GMM-based inversion method benefits from online adaptive learning and parallel computation. We demonstrate the efficacy of the proposed inversion method with videos reconstructed from simulated compressive video measurements, and from a real compressive video camera. We also use the GMM as a tool to investigate adaptive video compressive sensing, i.e., adaptive rate of temporal compression.

  17. Molecular weight scaling in critical polymer mixtures

    DEFF Research Database (Denmark)

    Gehlsen, M.D.; Rosedale, J.R.; Bates, F.S.

    1992-01-01

    , DELTA-X(D), and molecular weight by small-angle neutron scattering. The critical point for demixing was determined to scale as chi(eff,c) is similar to N(-delta) with delta = 1.01 +/- 0.05, where N is the degree of polymerization. This result confirms the mean-field prediction of Flory and Huggins.......Symmetric binary mixtures of partially deuterated polymers were prepared at the critical composition. The segment-segment interaction energy parameter chi(eff) was varied by adjusting the difference in deuterium content DELTA-X(D) between species. Chi(eff) was measured as a function of temperature...

  18. An equiratio mixture model for non-additive components : a case study for aspartame/acesulfame-K mixtures

    NARCIS (Netherlands)

    Schifferstein, H.N.J.

    1996-01-01

    The Equiratio Mixture Model predicts the psychophysical function for an equiratio mixture type on the basis of the psychophysical functions for the unmixed components. The model reliably estimates the sweetness of mixtures of sugars and sugar-alchohols, but is unable to predict intensity for asparta

  19. Investigation on the aggregation properties of cationic [60]fullerene derivative

    Institute of Scientific and Technical Information of China (English)

    WANG Guanwu; ZHAO Guoxia; YAN Lifeng

    2004-01-01

    The UV-Vis spectra, HRTEM and AFM images of cationic fullerene derivative 1 with ammonium head group directly connected to C60 skeleton in tetrahydrofuran (THF)-water (H2O) binary mixtures and in pure H2O were investigated. It was found that the UV-Vis spectra of ammonium 1 in the THF-H2O mixtures with THF% ≥ 20% were nearly overlapped, while those with THF% < 20% showed broadened and red-shifted peaks, indicating the formation of aggregates. Corresponding to the UV-Vis spectral changes,the solvatochromism of ammonium 1 in THF-H2O mixtures was observed. Ammonium 1 in binary THF-H2O mixtures existing as the monomer state could aggregate upon prolonged standing. Higher temperature and lower concentration speeded up the aggregation process.

  20. Prediction of saturated liquid enthalpy of refrigerant mixtures

    Institute of Scientific and Technical Information of China (English)

    CHEN ZeShao; CHEN JianXin; HU Peng

    2007-01-01

    New corresponding temperature and corresponding enthalpy of refrigerant mixtures were defined. The relationship between saturated liquid corresponding enthalpy and corresponding temperature of refrigerant mixtures accorded with that of pure components. The characteristic parameters of saturated liquid enthalpy difference of refrigerant mixtures were calculated by three methods according to the different application conditions. The generalized equation of saturated liquid enthalpy of refrigerant mixtures was presented. The calculated values were compared with the values in literature for five ternary and binary refrigerant mixtures, namely R404A, R407A, R407B, R32/R134a, and R410A. The overall average absolute deviation was less than 1.0%.

  1. Uniform designs for mixture-amount experiments and for mixture experiments under order restrictions

    Institute of Scientific and Technical Information of China (English)

    田国梁; 方开泰

    1999-01-01

    With order statistics of the uniform distribution on [0, 1], exponential and beta distributions, a stochastic representation is obtained for the uniform distribution over various domains, where A-type domains are closely associated with reliability growth analysis, order restricted statistical inference and isotonic regression theory, V-type domains are connected with the mixture-amount experiments, and T-type domains are well related to mixture experiments. With these stochastic representations, the corresponding uniform distribution and number-theoretic nets can be generated. This approach seems to be new and is called order statistics method. Some examples on reliability growth analysis and experimental design are presented.

  2. Investigation of Adding Proportion of RAP in Recycled Asphalt Mixture

    Directory of Open Access Journals (Sweden)

    Cao He

    2016-01-01

    Full Text Available According to the relationship between gradation and proportion of Reclaimed Asphalt Pavement (RAP and design gradation of recycled mixture, the authors discussed the influence of proportion of RAP on gradation adjustment of recycled mixture. And then, recycled mixture with 0%, 30%, 50%, 70% of RAP were made, and Influence of proportion of RAP on high and low temperature performance, water stability and anti-aging performance of recycled mixture were discussed. The results and analysis indicate that gradation of recycled mixture would not be adjusted to aiming gradation if proportion of RAP was too big. With the increase of proportion of RAP, high temperature performance and anti-aging performance of recycled mixture enhanced, but low temperature performance and water stability decayed sharply. In practical application, reasonable proportion of RAP should be determined according to gradation, performance demand and economy of recycled mixture.

  3. Systems and methods for removing components of a gas mixture

    Science.gov (United States)

    None

    2016-09-06

    A system for removing components of a gaseous mixture is provided comprising: a reactor fluid containing vessel having conduits extending therefrom, aqueous fluid within the reactor, the fluid containing a ligand and a metal, and at least one reactive surface within the vessel coupled to a power source. A method for removing a component from a gaseous mixture is provided comprising exposing the gaseous mixture to a fluid containing a ligand and a reactive metal, the exposing chemically binding the component of the gaseous mixture to the ligand. A method of capturing a component of a gaseous mixture is provided comprising: exposing the gaseous mixture to a fluid containing a ligand and a reactive metal, the exposing chemically binding the component of the gaseous mixture to the ligand, altering the oxidation state of the metal, the altering unbinding the component from the ligand, and capturing the component.

  4. Health and environmental effects of complex chemical mixtures: proceedings

    Energy Technology Data Exchange (ETDEWEB)

    1985-01-01

    The Office of Health and Environmental Research (OHER) of the Department of Energy supports a broad long-term research program on human health and environmental effects from potential exposure to energy-related complex chemical mixtures. The program seeks basic mechanistic data on the effects of complex mixtures at the cellular, molecular, and whole animal levels to aid in predicting human health effects and seeks ecological data on biological and physical transformations in the mixtures, concentrations of the mixtures in various compartments of the environment, and potential routes for human exposure to these mixtures (e.g., food chain). On June 17-18, 1985, OHER held its First Annual Technical Meeting on the Complex Chemical Mixtures Program in Chicago, IL. The primary purpose of the meeting was to enable principal investigators to report the research status and accomplishments of ongoing complex chemical mixture studies supported by OHER. To help focus future research directions round table discussions were conducted.

  5. A simple mixture to enhance muscle transmittance

    Science.gov (United States)

    Oliveira, Luís; Lage, Armindo; Clemente, Manuel Pais; Tuchin, Valery V.

    2008-06-01

    Skeletal muscle is a fibrous tissue composed by muscle fibers and interstitial fluid. Due to this constitution, the muscle presents a non uniform refractive index profile that origins strong light scattering. One way to improve tissue transmittance is to reduce this refractive index mismatch by immersing the muscle in an optical clearing agent. As a consequence of such immersion tissue also suffers dehydration. The study of the optical clearing effect created by a simple mixture composed by ethanol, glycerol and distilled water has proven its effectiveness according to the variations observed in the parameters under study. The effect was characterized in terms of its magnitude, time duration and histological variations. The applied treatment has created a small reduction of the global sample refractive index that is justified by the long time rehydration caused by water in the immersing solution. From the reduction in sample pH we could also identify the dehydration process created in the sample. The immersion treatment has originated fiber bundle contraction and a spread distribution of the muscle fiber bundles inside. New studies with the mixture used, or with other combinations of its constituents might be interesting to perform with the objective to develop new clinical procedures.

  6. Non-equilibrium properties of hadronic mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Prakasch, Madappa (State Univ. of New York, Stony Brook, NY (United States). Physics Dept.); Prakasch, Manju (State Univ. of New York, Stony Brook, NY (United States). Physics Dept.); Venugopalan, R. (State Univ. of New York, Stony Brook, NY (United States). Physics Dept.); Welke, G. (Michigan State Univ., East Lansing, MI (United States). National Superconducting Cyclotron Lab.)

    1993-05-01

    The equilibration of hot hadronic matter is studied in the framework of relativistic kinetic theory. Various non-equilibrium properties of a mixture comprised of pions, kaons and nucleons are calculated in the dilute limit for small deviations from local thermal equilibrium. Interactions between these constituents are specified through the empirical phase shifts. The properties calculated include the relaxation/collision times, momentum and energy persistence ratios in elastic collisions, and transport properties such as the viscosity, the thermal conductivity, and the diffusion and thermal diffusion coefficients. The Chapman-Enskog formalism is extended to extract relaxation times associated with shear and heat flows, and drag and diffusion flows in a mixture. The equilibrium number concentration of the constituents is chosen to mimic those expected in the mid-rapidity interval of CERN and RHIC experiments. In this case, kaons and nucleons are found to equilibrate significantly more slowly than pions. These results shed new light on the influence of collective flow effects on the transverse momentum distributions of kaons and nucleons versus those of pions in ultra-relativistic nuclear collisions. (orig.)

  7. Spinodal Decomposition in Mixtures Containing Surfactants

    Science.gov (United States)

    Melenekvitz, J.

    1998-03-01

    Spinodal decomposition in mixtures containing two immiscible liquids (A and B) plus surfactant was investigated using a recently developed (J. Melenkevitz and S. H. Javadpour, J. Chem. Phys., 107, 623 (1997).) 3-component Ginzburg-Landau model. The time dependent Ginzburg-Landau (TDGL) equations governing the evolution of structure were numerically integrated in 2-dimensions. We found the growth rate of the average domain size, R(t), decreased with increasing surfactant concentration over a wide range of relative amounts of A and B. This can be attributed to the surfactant accumulating at the growing interface between the immiscible liquids, which leads to a reduction in the surface tension. At late times, the growth rate was noticeably altered when thermal fluctuations were added to the numerical simulations. In this case, power law behavior was observed for R(t) at late times, R(t) ~ t^α, with the exponent α decreasing as the amount of surfactant increased. The dynamics at early times were determined by linearizing the TDGL equations about a uniformly mixed state. The growth rate at ealry times was found to be strongly dependent on the model parameters describing the surfactant miscibility in A and B and the surfactant strength. Comparison with recent measurements on SBR / PB mixtures with added PB-SBR diblock copolymer will also be presented.

  8. A mixture approach to vagueness and ambiguity.

    Directory of Open Access Journals (Sweden)

    Steven Verheyen

    Full Text Available When asked to indicate which items from a set of candidates belong to a particular natural language category inter-individual differences occur: Individuals disagree which items should be considered category members. The premise of this paper is that these inter-individual differences in semantic categorization reflect both ambiguity and vagueness. Categorization differences are said to be due to ambiguity when individuals employ different criteria for categorization. For instance, individuals may disagree whether hiking or darts is the better example of sports because they emphasize respectively whether an activity is strenuous and whether rules apply. Categorization differences are said to be due to vagueness when individuals employ different cut-offs for separating members from non-members. For instance, the decision to include hiking in the sports category or not, may hinge on how strenuous different individuals require sports to be. This claim is supported by the application of a mixture model to categorization data for eight natural language categories. The mixture model can identify latent groups of categorizers who regard different items likely category members (i.e., ambiguity with categorizers within each of the groups differing in their propensity to provide membership responses (i.e., vagueness. The identified subgroups are shown to emphasize different sets of category attributes when making their categorization decisions.

  9. Predicting the toxicity of metal mixtures.

    Science.gov (United States)

    Balistrieri, Laurie S; Mebane, Christopher A

    2014-01-01

    The toxicity of single and multiple metal (Cd, Cu, Pb, and Zn) solutions to trout is predicted using an approach that combines calculations of: (1) solution speciation; (2) competition and accumulation of cations (H, Ca, Mg, Na, Cd, Cu, Pb, and Zn) on low abundance, high affinity and high abundance, low affinity biotic ligand sites; (3) a toxicity function that accounts for accumulation and potency of individual toxicants; and (4) biological response. The approach is evaluated by examining water composition from single metal toxicity tests of trout at 50% mortality, results of theoretical calculations of metal accumulation on fish gills and associated mortality for single, binary, ternary, and quaternary metal solutions, and predictions for a field site impacted by acid rock drainage. These evaluations indicate that toxicity of metal mixtures depends on the relative affinity and potency of toxicants for a given aquatic organism, suites of metals in the mixture, dissolved metal concentrations and ratios, and background solution composition (temperature, pH, and concentrations of major ions and dissolved organic carbon). A composite function that incorporates solution composition, affinity and competition of cations for two types of biotic ligand sites, and potencies of hydrogen and individual metals is proposed as a tool to evaluate potential toxicity of environmental solutions to trout.

  10. Transport and radiation in complex LTE mixtures

    Science.gov (United States)

    Janssen, Jesper; Peerenboom, Kim; Suijker, Jos; Gnybida, Mykhailo; van Dijk, Jan

    2014-10-01

    Complex LTE mixtures are for example encountered in re-entry, welding, spraying and lighting. These mixtures typically contain a rich chemistry in combination with large temperature gradients. LTE conditions are also interesting because they can aid in the validation of NLTE algorithms. An example is the calculation of transport properties. In this work a mercury free high intensity discharge lamp is considered. The investigation focusses on using salts like InI or SnI as a buffer species. By using these species a dominant background gas like mercury is no longer present. As a consequence the diffusion algorithms based on Fick's law are no longer applicable and the Stefan-Maxwell equations must be solved. This system of equations is modified with conservation rules to set a coldspot pressure for saturated species and enforce the mass dosage for unsaturated species. The radiative energy transport is taken into account by raytracing. Quantum mechanical simulations have been used to calculate the potential curves and the transition dipole moments for indium with iodine and tin with iodine. The results of these calculations have been used to predict the quasistatic broadening by iodine. The work was supported by the project SCHELP from the Belgium IWT (Project Number 110003) and the CATRENE SEEL Project (CA502).

  11. Foaming characteristics of refigerant/lubricant mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Goswami, D.Y.; Shah, D.O.; Jotshi, C.K.; Bhagwat, S.; Leung, M.; Gregory, A.

    1997-04-01

    The air-conditioning and refrigeration industry has moved to HFC refrigerants which have zero ozone depletion and low global warming potential due to regulations on CFC and HCFC refrigerants and concerns for the environment. The change in refrigerants has prompted the switch from mineral oil and alkylbenzene lubricants to polyolester-based lubricants. This change has also brought about a desire for lubricant, refrigerant and compressor manufacturers to understand the foaming properties of alternative refrigerant/ lubricant mixtures, as well as the mechanisms which affect these properties. The objectives of this investigation are to experimentally determine the foaming absorption and desorption rates of HFC and blended refrigerants in polyolester lubricant and to define the characteristics of the foam formed when the refrigerant leaves the refrigerant/ lubricant mixture after being exposed to a pressure drop. The refrigerants being examined include baseline refrigerants: CFC-12 (R-12) and HCFC-22 (R-22); alternative refrigerants: HFC-32 (R-32), R-125, R-134a, and R-143a; and blended refrigerants: R-404A, R-407C, and R-410A. The baseline refrigerants are tested with ISO 32 (Witco 3GS) and ISO 68 (4GS) mineral oils while the alternative and blended refrigerants are tested with two ISO 68 polyolesters (Witco SL68 and ICI RL68H).

  12. Optical properties of a heated cornstarch mixture

    Science.gov (United States)

    Vazquez-Landaverde, Pedro A.; Morales Sánchez, Eduardo; Huerta-Ruelas, Jorge A.

    2007-03-01

    In this study, the objective was to evaluate optical properties of a corn starch-water mixture as descriptors of its behavior under processing conditions. A solution of corn starch in water was prepared and heated from 25 to 85°C in a temperature-controlled optical cell. For the measurement of optical properties, a polarized laser beam modulated through a photoelastic modulator and an analyzer, was used as optical probe. It was possible to measure transmitted light, along with optical rotation. Optical measurements showed changes related to temperature dependent phenomena such as starch granule swelling and gelatinization, in the ranges 25 to 60°C, 60 to 85°C. Above 80°C transmission values were higher, due to the solution clarification caused by corn starch gelatinization. Regarding optical rotation, it was difficult to obtain reliable measurements at low temperatures due to the high turbidity of the system. However, once gel was formed at higher temperatures, optical rotation and light transmission increased. This study demonstrated that optical techniques are suitable for the study of the behavior of water-starch mixtures under processing conditions such as heating, revealing a promising future for the monitoring of such phenomena in the production line to lower costs and improve product quality.

  13. Thermodynamics of organic mixtures containing amines

    Energy Technology Data Exchange (ETDEWEB)

    Gonzalez, Juan Antonio [G.E.T.E.F. Dpto Termodinamica y Fisica Aplicada, Facultad de Ciencias, Universidad de Valladolid, Valladolid 47071 (Spain)]. E-mail: jagl@termo.uva.es; Mozo, Ismael [G.E.T.E.F. Dpto Termodinamica y Fisica Aplicada, Facultad de Ciencias, Universidad de Valladolid, Valladolid 47071 (Spain); Fuente, Isaias Garcia de la [G.E.T.E.F. Dpto Termodinamica y Fisica Aplicada, Facultad de Ciencias, Universidad de Valladolid, Valladolid 47071 (Spain); Cobos, Jose Carlos [G.E.T.E.F. Dpto Termodinamica y Fisica Aplicada, Facultad de Ciencias, Universidad de Valladolid, Valladolid 47071 (Spain)

    2006-02-01

    Binary mixtures containing pyridine (PY), or 2-methylpyridine (2MPY) or 3-methylpyridine (3MPY) or 4-methylpyridine (4MPY) and an organic solvent as benzene, toluene, alkane, or 1-alkanol are investigated in the framework of DISQUAC. The corresponding interaction parameters are reported. The model describes accurately a whole set of thermodynamic properties: vapor-liquid equilibria (VLE), liquid-liquid equilibria (LLE), solid-liquid equilibria (SLE), molar excess Gibbs energies (G{sup E}), molar excess enthalpies (H{sup E}), molar excess heat capacities at constant pressure (C{sub P}{sup E}) and the concentration-concentration structure factor (S{sub CC}(0)). It is remarkable that DISQUAC correctly predicts the W-shaped curve of the C{sub P}{sup E} of the pyridine + n-hexadecane system. The model can be applied successfully to mixtures with strong positive or negative deviations from the Raoult's law. DISQUAC improves the theoretical results from UNIFAC (Dortmund version). The replacement of pyridine by a methylpyridine leads to a weakening of the amine-amine interactions, ascribed to the steric effect caused by the methyl group attached to the aromatic ring. This explains that for a given solvent (alkane, 1-alkanol) H{sup E}(pyridine)>H{sup E}(methylpyridine)

  14. Rayleigh-Rice Mixture Parameter Estimation via EM Algorithm for Change Detection in Multispectral Images.

    Science.gov (United States)

    Zanetti, Massimo; Bovolo, Francesca; Bruzzone, Lorenzo

    2015-12-01

    The problem of estimating the parameters of a Rayleigh-Rice mixture density is often encountered in image analysis (e.g., remote sensing and medical image processing). In this paper, we address this general problem in the framework of change detection (CD) in multitemporal and multispectral images. One widely used approach to CD in multispectral images is based on the change vector analysis. Here, the distribution of the magnitude of the difference image can be theoretically modeled by a Rayleigh-Rice mixture density. However, given the complexity of this model, in applications, a Gaussian-mixture approximation is often considered, which may affect the CD results. In this paper, we present a novel technique for parameter estimation of the Rayleigh-Rice density that is based on a specific definition of the expectation-maximization algorithm. The proposed technique, which is characterized by good theoretical properties, iteratively updates the parameters and does not depend on specific optimization routines. Several numerical experiments on synthetic data demonstrate the effectiveness of the method, which is general and can be applied to any image processing problem involving the Rayleigh-Rice mixture density. In the CD context, the Rayleigh-Rice model (which is theoretically derived) outperforms other empirical models. Experiments on real multitemporal and multispectral remote sensing images confirm the validity of the model by returning significantly higher CD accuracies than those obtained by using the state-of-the-art approaches.

  15. Breakdown Voltage Research of Penning Gas Mixture in Plasma Display Panel

    Institute of Scientific and Technical Information of China (English)

    Guo Bingang; Liu Chunliang; Song Zhongxiao; Fan Yufeng; Xia Xing; Liu Liu; Fan Duowang

    2005-01-01

    Paschen law and equations, which ignore the influence of the Penning ionization on the electron ionization coefficient (α), are always used as the approximation of the breakdown voltage criterion of the Penning gas mixture in current researches of discharge characteristics of the plasma display panel (PDP). It is doubtful that whether their results match the facts. Based on the Townsend gas self-sustaining discharge condition and the chemical kinetics analysis of the Penning gas mixture discharging in PDP, the empirical equation to describe the breakdown of the Penning gas mixture is given. It is used to calculate the breakdown voltage curves of Ne-Xe/MgO and Ne-Ar/MgO in a testing macroscopic discharge cell of AC-PDP. The effective secondary electron emission coefficients (γeff) of the MgO protective layers are derived by comparing the breakdown voltage curves obtained from the empirical equation with the experimental data of breakdown voltages. In comparison with the results calculated by the Paschen law and the equation which ignore the influence of the Penning ionization on α , the results calculated by the empirical equation have better conformity with experimental data. The empirical equation characterizes the breakdown of the Penning gas mixture in PDP effectively, and gives a convenient way to study its breakdown characteristics and the secondary electron emission behaviors.

  16. Mean centering of double divisor ratio spectra, a novel spectrophotometric method for analysis of ternary mixtures

    Science.gov (United States)

    Hassan, Said A.; Elzanfaly, Eman S.; Salem, Maissa Y.; El-Zeany, Badr A.

    2016-01-01

    A novel spectrophotometric method was developed for determination of ternary mixtures without previous separation, showing significant advantages over conventional methods. The new method is based on mean centering of double divisor ratio spectra. The mathematical explanation of the procedure is illustrated. The method was evaluated by determination of model ternary mixture and by the determination of Amlodipine (AML), Aliskiren (ALI) and Hydrochlorothiazide (HCT) in laboratory prepared mixtures and in a commercial pharmaceutical preparation. For proper presentation of the advantages and applicability of the new method, a comparative study was established between the new mean centering of double divisor ratio spectra (MCDD) and two similar methods used for analysis of ternary mixtures, namely mean centering (MC) and double divisor of ratio spectra-derivative spectrophotometry (DDRS-DS). The method was also compared with a reported one for analysis of the pharmaceutical preparation. The method was validated according to the ICH guidelines and accuracy, precision, repeatability and robustness were found to be within the acceptable limits.

  17. Distributed Density Estimation Based on a Mixture of Factor Analyzers in a Sensor Network

    Directory of Open Access Journals (Sweden)

    Xin Wei

    2015-08-01

    Full Text Available Distributed density estimation in sensor networks has received much attention due to its broad applicability. When encountering high-dimensional observations, a mixture of factor analyzers (MFA is taken to replace mixture of Gaussians for describing the distributions of observations. In this paper, we study distributed density estimation based on a mixture of factor analyzers. Existing estimation algorithms of the MFA are for the centralized case, which are not suitable for distributed processing in sensor networks. We present distributed density estimation algorithms for the MFA and its extension, the mixture of Student’s t-factor analyzers (MtFA. We first define an objective function as the linear combination of local log-likelihoods. Then, we give the derivation process of the distributed estimation algorithms for the MFA and MtFA in details, respectively. In these algorithms, the local sufficient statistics (LSS are calculated at first and diffused. Then, each node performs a linear combination of the received LSS from nodes in its neighborhood to obtain the combined sufficient statistics (CSS. Parameters of the MFA and the MtFA can be obtained by using the CSS. Finally, we evaluate the performance of these algorithms by numerical simulations and application example. Experimental results validate the promising performance of the proposed algorithms.

  18. Thermodynamic Properties of the Azeotropic Mixture of Acetone, Cyclohexane and Methanol

    Institute of Scientific and Technical Information of China (English)

    WANG Xiu-Rong; NAN Zhao-Dong; TAN Zhi-Cheng

    2006-01-01

    Molar heat capacities of the pure samples of acetone, methanol and the azeotropic mixture composed of acetone,cyclohexane and methanol were measured by an adiabatic calorimeter from 78 to 320 K. The solid-solid and solid-liquid phase transitions of the pure samples and the mixture were determined based on the curve of the heat capacity with respect to temperature. The phase transitions took place at (126.16±0.68) and (178.96±1.47) K for the sample of acetone, (157.79±0.95) and (175.93±0.95) K for methanol, which were corresponding to the solid-solid and the solid-liquid phase transitions of the acetone and the methanol, respectively. And the phase transitions occurred in the temperature ranges of 120 to 190 K and 278 to 280 K corresponding to the solid-solid and the solid-liquid phase transitions of mixture of acetone, cyclohexane and methanol, respectively. The thermodynamic functions and the excess thermodynamic functions of the mixture relative to standard temperature of 298.15 K were derived based on the relationships of the thermodynamic functions and the function of the measured heat capacity with respect to temperature.

  19. Extension of Compressibility-Route Cubic Equations of State and the Radial Distribution Functions at Contact to Multi-Component Hard-Sphere Mixtures

    Science.gov (United States)

    Sun, Jiu-Xun; Jin, Ke; Cai, Ling-Cang; Wu, Qiang

    2014-08-01

    The equation of state (EOS) for hard-sphere fluid derived from compressibility routes of Percus-Yevick theory (PYC) is extended. The two parameters are determined by fitting well-known virial coefficients of pure fluid. The extended cubic EOS can be directly extended to multi-component mixtures, merely demanding the EOS of mixtures also is cubic and combining two physical conditions for the radial distribution functions at contact (RDFC) of mixtures. The calculated virial coefficients of pure fluid and predicted compressibility factors and RDFC for both pure fluid and mixtures are excellent as compared with the simulation data. The values of RDFC for mixtures with extremely large size ratio 10 are far better than the BGHLL expressions in literature.

  20. Ecotoxicological characterization of polyoxyethylene glycerol ester non-ionic surfactants and their mixtures with anionic and non-ionic surfactants.

    Science.gov (United States)

    Ríos, Francisco; Fernández-Arteaga, Alejandro; Lechuga, Manuela; Fernández-Serrano, Mercedes

    2017-03-03

    This paper reports on a study that investigated the aquatic toxicity of new non-ionic surfactants derived from renewable raw materials, polyoxyethylene glycerol ester (PGE), and their binary mixtures with anionic and non-ionic surfactants. Toxicity of pure PGEs was determined using representative organisms from different trophic levels: luminescent bacteria (Vibrio fischeri), microalgae (Pseudokirchneriella subcapitata), and freshwater crustaceans (Daphnia magna). Relationships between toxicity and the structural parameters such as unit of ethylene oxide (EO) and hydrophilic-lipophilic balance (HLB) were evaluated. Critical micellar concentration (CMC) in the conditions of the toxicity test was also determined. It was found that the toxicity of the aqueous solutions of PGE decreased when the number of EO units in the molecule, HLB, and CMC increased. PGEs showed lower CMC in marine medium, and the toxicity to V. ficheri is lower when the CMC was higher. Given their non-polar nature, narcosis was expected to be the primary mode of toxic action of PGEs. For the mixture of surfactants, we observed that the mixtures with PGE that had the higher numbers of EO units were more toxic than the aqueous solutions of pure surfactants. Moreover, we found that concentration addition was the type of action more likely to occur for mixtures of PGE with lower numbers of EO units with non-ionic surfactants (alkylpolyglucoside and fatty alcohol ethoxylate), whereas for the mixture of PGE with lower EO units and anionic surfactant (ether carboxylic derivative), the most common response type was response addition. In case of mixtures involving amphoteric surfactants and PGEs with the higher numbers of EO units, no clear pattern with regard to the mixture toxicity response type could be observed.

  1. Derived logarithmic geometry I

    OpenAIRE

    Steffen, Sagave; Timo, Schurg; Gabriele, Vezzosi

    2016-01-01

    In order to develop the foundations of logarithmic derived geometry, we introduce a model category of logarithmic simplicial rings and a notion of derived log \\'etale maps and use this to define derived log stacks.

  2. Analytical processing of binary mixture information by olfactory bulb glomeruli.

    Directory of Open Access Journals (Sweden)

    Max L Fletcher

    Full Text Available Odors are rarely composed of a single compound, but rather contain a large and complex variety of chemical components. Often, these mixtures are perceived as having unique qualities that can be quite different than the combination of their components. In many cases, a majority of the components of a mixture cannot be individually identified. This synthetic processing of odor information suggests that individual component representations of the mixture must interact somewhere along the olfactory pathway. The anatomical nature of sensory neuron input into segregated glomeruli with the bulb suggests that initial input of odor information into the bulb is analytic. However, a large network of interneurons within the olfactory bulb could allow for mixture interactions via mechanisms such as lateral inhibition. Currently in mammals, it is unclear if postsynaptic mitral/tufted cell glomerular mixture responses reflect the analytical mixture input, or provide the initial basis for synthetic processing with the olfactory system. To address this, olfactory bulb glomerular binary mixture representations were compared to representations of each component using transgenic mice expressing the calcium indicator G-CaMP2 in olfactory bulb mitral/tufted cells. Overall, dorsal surface mixture representations showed little mixture interaction and often appeared as a simple combination of the component representations. Based on this, it is concluded that dorsal surface glomerular mixture representations remain largely analytical with nearly all component information preserved.

  3. Mixture Model and MDSDCA for Textual Data

    Science.gov (United States)

    Allouti, Faryel; Nadif, Mohamed; Hoai An, Le Thi; Otjacques, Benoît

    E-mailing has become an essential component of cooperation in business. Consequently, the large number of messages manually produced or automatically generated can rapidly cause information overflow for users. Many research projects have examined this issue but surprisingly few have tackled the problem of the files attached to e-mails that, in many cases, contain a substantial part of the semantics of the message. This paper considers this specific topic and focuses on the problem of clustering and visualization of attached files. Relying on the multinomial mixture model, we used the Classification EM algorithm (CEM) to cluster the set of files, and MDSDCA to visualize the obtained classes of documents. Like the Multidimensional Scaling method, the aim of the MDSDCA algorithm based on the Difference of Convex functions is to optimize the stress criterion. As MDSDCA is iterative, we propose an initialization approach to avoid starting with random values. Experiments are investigated using simulations and textual data.

  4. CRITICALITY CURVES FOR PLUTONIUM HYDRAULIC FLUID MIXTURES

    Energy Technology Data Exchange (ETDEWEB)

    WITTEKIND WD

    2007-10-03

    This Calculation Note performs and documents MCNP criticality calculations for plutonium (100% {sup 239}Pu) hydraulic fluid mixtures. Spherical geometry was used for these generalized criticality safety calculations and three geometries of neutron reflection are: {sm_bullet}bare, {sm_bullet}1 inch of hydraulic fluid, or {sm_bullet}12 inches of hydraulic fluid. This document shows the critical volume and critical mass for various concentrations of plutonium in hydraulic fluid. Between 1 and 2 gallons of hydraulic fluid were discovered in the bottom of HA-23S. This HA-23S hydraulic fluid was reported by engineering to be Fyrquel 220. The hydraulic fluid in GLovebox HA-23S is Fyrquel 220 which contains phosphorus. Critical spherical geometry in air is calculated with 0 in., 1 in., or 12 inches hydraulic fluid reflection.

  5. POROSITY CALCULATION OF MIXTURES OF FIBROUS PARTICLES

    Institute of Scientific and Technical Information of China (English)

    Ruping Zou; Aibing Yu

    2003-01-01

    The initial forming of fiber blend to high green density, i.e. the packing of fibrous particles, is important to the reinforcement of composite materials. It is very useful to develop a general predictive method for the optimum selection of particle mixtures for the property control of ceramic or composite products. This paper presents such a mathematical model developed on the basis of the similarity analysis between the spherical and non-spherical particle packings and assesses its applicability to the packing of fibrous particles with discrete and/or continuous length distributions. The results indicate that the model can predict this packing system well and hence provide an effective way to solve various packing problems in the composite materials processing.

  6. Processes assessment in binary mixture plant

    Directory of Open Access Journals (Sweden)

    N. Shankar Ganesh, T. Srinivas

    2013-01-01

    Full Text Available Binary fluid system has an efficient system of heat recovery compared to a single fluid system due to a better temperature match between hot and cold fluids. There are many applications with binary fluid system i.e. Kalina power generation, vapor absorption refrigeration, combined power and cooling etc. Due to involvement of three properties (pressure, temperature and concentration in the processes evaluation, the solution is complicated compared to a pure substance. The current work simplifies this complex nature of solution and analyzes the basic processes to understand the processes behavior in power generation as well as cooling plants. Kalina power plant consists of regenerator, heat recovery vapor generator, condenser, mixture, separator, turbine, pump and throttling device. In addition to some of these components, the cooling plant consists of absorber which is similar in operation of condenser. The amount of vapor at the separator decreases with an increase in its pressure and temperature.

  7. Thermodynamic modeling of CO2 mixtures

    DEFF Research Database (Denmark)

    Bjørner, Martin Gamel

    performed satisfactorily and predicted the general behavior of the systems, but qCPA used fewer adjustable parameters to achieve similar predictions. It has been demonstrated that qCPA is a promising model which, compared to CPA, systematically improves the predictions of the experimentally determined phase......, accurate predictions of the thermodynamic properties and phase equilibria of mixtures containing CO2 are challenging with classical models such as the Soave-Redlich-Kwong (SRK) equation of state (EoS). This is believed to be due to the fact, that CO2 has a large quadrupole moment which the classical models...... do not explicitly account for. In this thesis, in an attempt to obtain a physically more consistent model, the cubicplus association (CPA) EoS is extended to include quadrupolar interactions. The new quadrupolar CPA (qCPA) can be used with the experimental value of the quadrupolemoment...

  8. Urea and deuterium mixtures at high pressures

    Energy Technology Data Exchange (ETDEWEB)

    Donnelly, M., E-mail: m.donnelly-2@sms.ed.ac.uk; Husband, R. J.; Frantzana, A. D.; Loveday, J. S. [Centre for Science at Extreme Conditions and School of Physics and Astronomy, The University of Edinburgh, Erskine Williamson Building, Peter Guthrie Tait Road, The King’s Buildings, Edinburgh EH9 3FD (United Kingdom); Bull, C. L. [ISIS, Rutherford Appleton Laboratory, Oxford Harwell, Didcot OX11 0QX (United Kingdom); Klotz, S. [IMPMC, CNRS UMR 7590, Université P and M Curie, 4 Place Jussieu, 75252 Paris (France)

    2015-03-28

    Urea, like many network forming compounds, has long been known to form inclusion (guest-host) compounds. Unlike other network formers like water, urea is not known to form such inclusion compounds with simple molecules like hydrogen. Such compounds if they existed would be of interest both for the fundamental insight they provide into molecular bonding and as potential gas storage systems. Urea has been proposed as a potential hydrogen storage material [T. A. Strobel et al., Chem. Phys. Lett. 478, 97 (2009)]. Here, we report the results of high-pressure neutron diffraction studies of urea and D{sub 2} mixtures that indicate no inclusion compound forms up to 3.7 GPa.

  9. Bioavailability and variability of biphasic insulin mixtures

    DEFF Research Database (Denmark)

    Søeborg, Tue; Rasmussen, Christian Hove; Mosekilde, Erik

    2012-01-01

    Absorption of subcutaneously administered insulin is associated with considerable variability. Some of this variability was quantitatively explained for both soluble insulin and insulin suspensions in a recent contribution to this journal (Søeborg et al., 2009). In the present article......, the absorption kinetics for mixtures of insulins is described. This requires that the bioavailability of the different insulins is considered. A short review of insulin bioavailability and a description of the subcutaneous depot thus precede the presentation of possible mechanisms associated with subcutaneous...... insulin degradation. Soluble insulins are assumed to be degraded enzymatically in the subcutaneous tissue. Suspended insulin crystals form condensed heaps that are assumed to be degraded from their surface by invading macrophages. It is demonstrated how the shape of the heaps affects the absorption...

  10. A microfluidic dialysis device for complex biological mixture SERS analysis

    KAUST Repository

    Perozziello, Gerardo

    2015-08-01

    In this paper, we present a microfluidic device fabricated with a simple and inexpensive process allowing rapid filtering of peptides from a complex mixture. The polymer microfluidic device can be used for sample preparation in biological applications. The device is fabricated by micromilling and solvent assisted bonding, in which a microdialysis membrane (cut-off of 12-14 kDa) is sandwiched in between an upper and a bottom microfluidic chamber. An external frame connects the microfluidic device to external tubes, microvalves and syringe pumps. Bonding strength and interface sealing are pneumatically tested. Microfluidic protocols are also described by using the presented device to filter a sample composed of specific peptides (MW 1553.73 Da, at a concentration of 1.0 ng/μl) derived from the BRCA1 protein, a tumor-suppressor molecule which plays a pivotal role in the development of breast cancer, and albumin (MW 66.5 kDa, at a concentration of 35 μg/μl), the most represented protein in human plasma. The filtered samples coming out from the microfluidic device were subsequently deposited on a SERS (surface enhanced Raman scattering) substrate for further analysis by Raman spectroscopy. By using this approach, we were able to sort the small peptides from the bigger and highly concentrated protein albumin and to detect them by using a label-free technique at a resolution down to 1.0 ng/μl.

  11. Compressive sensing by learning a Gaussian mixture model from measurements.

    Science.gov (United States)

    Yang, Jianbo; Liao, Xuejun; Yuan, Xin; Llull, Patrick; Brady, David J; Sapiro, Guillermo; Carin, Lawrence

    2015-01-01

    Compressive sensing of signals drawn from a Gaussian mixture model (GMM) admits closed-form minimum mean squared error reconstruction from incomplete linear measurements. An accurate GMM signal model is usually not available a priori, because it is difficult to obtain training signals that match the statistics of the signals being sensed. We propose to solve that problem by learning the signal model in situ, based directly on the compressive measurements of the signals, without resorting to other signals to train a model. A key feature of our method is that the signals being sensed are treated as random variables and are integrated out in the likelihood. We derive a maximum marginal likelihood estimator (MMLE) that maximizes the likelihood of the GMM of the underlying signals given only their linear compressive measurements. We extend the MMLE to a GMM with dominantly low-rank covariance matrices, to gain computational speedup. We report extensive experimental results on image inpainting, compressive sensing of high-speed video, and compressive hyperspectral imaging (the latter two based on real compressive cameras). The results demonstrate that the proposed methods outperform state-of-the-art methods by significant margins.

  12. Critical Phenomena in Liquid-Liquid Mixtures

    Science.gov (United States)

    Jacobs, D. T.

    2000-04-01

    Critical phenomena provide intriguing and essential insight into many issues in condensed matter physics because of the many length scales involved. Large density or concentration fluctuations near a system's critical point effectively mask the identity of the system and produce universal phenomena that have been well studied in simple liquid-vapor and liquid-liquid systems. Such systems have provided useful model systems to test theoretical predictions which can then be extended to more complicated systems. Along various thermodynamic paths, several quantities exhibit a simple power-law dependence close to the critical point. The critical exponents describing these relationships are universal and should depend only on a universality class determined by the order-parameter and spatial dimensionality of the system. Liquid gas, binary fluid mixtures, uniaxial ferromagnetism, polymer-solvent, and protein solutions all belong to the same (Ising model) universality class. The diversity of critical systems that can be described by universal relations indicates that experimental measurements on one system should yield the same information as on another. Our experimental investigations have tested existing theory and also extended universal behavior into new areas. By measuring the coexistence curve, heat capacity, thermal expansion and static light scattering (turbidity) in various liquid-liquid and polymer-solvent systems, we have determined critical exponents and amplitudes that have sometimes confirmed and other times challenged current theory. Recent experiments investigating the heat capacity and light scattering in a liquid-liquid mixture very close to the critical point will be discussed. This research is currently supported by The Petroleum Research Fund and by NASA grant NAG8-1433 with some student support from NSF-DMR 9619406.

  13. A WEIGHTED GENERAL DISCRETE FOURIER TRANSFORM FOR THE FREQUENCY-DOMAIN BLIND SOURCE SEPARATION OF CONVOLUTIVE MIXTURES

    Institute of Scientific and Technical Information of China (English)

    2008-01-01

    This letter deals with the frequency domain Blind Source Separation of Convolutive Mixtures(CMBSS).From the frequency representation of the"overlap and save",a Weighted General Discrete Fourier Transform (WGDFT) is derived to replace the traditional Discrete Fourier Transform (DFT).The mixing matrix on each frequency bin could be estimated more precisely from WGDFT coefficients than from DFT coefficients,which improves separation performance.Simulation results verify the validity of WGDFT for frequency domain blind source separation of convolutive mixtures.

  14. Energy Analysis of a Biomass Co-firing Based Pulverized Coal Power Generation System

    Directory of Open Access Journals (Sweden)

    Marc A. Rosen

    2012-03-01

    Full Text Available The results are reported of an energy analysis of a biomass/coal co-firing based power generation system, carried out to investigate the impacts of biomass co-firing on system performance. The power generation system is a typical pulverized coal-fired steam cycle unit, in which four biomass fuels (rice husk, pine sawdust, chicken litter, and refuse derived fuel and two coals (bituminous coal and lignite are considered. Key system performance parameters are evaluated for various fuel combinations and co-firing ratios, using a system model and numerical simulation. The results indicate that plant energy efficiency decreases with increase of biomass proportion in the fuel mixture, and that the extent of the decrease depends on specific properties of the coal and biomass types.

  15. Thermodynamic Investigation of the Azeotropic Mixture Composed of Water and Benzene

    Institute of Scientific and Technical Information of China (English)

    NAN,Zhao-Dong(南照东); TAN,Zhi-Cheng(谭志诚)

    2004-01-01

    The molar heat capacity of the azeotropic mixture composed of water and benzene was measured by an adiabatic calorimeter in the temperature range from 80 to 320 K. The phase transitions took place in the temperature range from 265.409 to 275.165 K and 275.165 to 279.399 K. The phase transition temperatures were determined to be 272.945 and 278.339 K, which were corresponding to the solid-liquid phase transitions of water and benzene, respectively. The thermodynamic functions and the excess thermodynamic functions of the mixture relative to standard temperature 298.15 K were derived from the relationships of the thermodynamic functions and the function of the measured heat capacity with respect to temperature.

  16. Measurement of electron attachment coefficient in oxygen and oxygen-argon mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Jeon, B.; Nakamura, Y. [Keio University, Tokyo (Japan)

    1998-07-01

    We analyzed the electron arrival time signal measured in pure oxygen and in dilute oxygen-argon mixtures by using a double shutter electron drift tube with variable drift distance and derived the density normalized attachment coefficient for respective gases. The present attachment coefficient determined for pure oxygen agreed well with previously reported values and we confirmed that the present apparatus was useful in determining electron attachment coefficient even if there were no ionization, when there will be no steady state current growth and, hence, the steady state Townsend (SST) method can not be applied in principle. The measured attachment coefficients in the mixtures agreed very well with the calculation using our latest cross section set for the oxygen molecule and that `II be a confirmation for the validity of the cross section set. 11 refs., 8 figs., 1 tab.

  17. Measurements of the Liquid Viscosities of Mixtures of Isobutane with Squalane to 30 MPa

    Science.gov (United States)

    Kumagai, A.; Tomida, D.; Yokoyama, C.

    2007-08-01

    The viscosities of liquid mixtures of isobutane with squalane, which seem to be representative of mixtures of refrigerants with refrigeration oil, were measured from 273.15 to 333.15 K at pressures to 30 MPa using a falling-body viscometer. The uncertainty of the measurements was estimated to be no larger than 2.9%. The experimental viscosity values were fitted with a Tait-like equation within 2.8%. There are large deviations between the experimental data and calculated values predicted by the equation of Kanti et al., which is derived from Flory’s theory. By introducing two index numbers of the energetic mixing rule into the equation, the predictions could be improved considerably.

  18. Direct Conversion of Mono- and Polysaccharides into 5-Hydroxymethylfurfural Using Ionic-Liquid Mixtures.

    Science.gov (United States)

    Siankevich, Sviatlana; Fei, Zhaofu; Scopelliti, Rosario; Jessop, Philip G; Zhang, Jiaguang; Yan, Ning; Dyson, Paul J

    2016-08-23

    Platform chemicals are usually derived from petrochemical feedstocks. A sustainable alternative commences with lignocellulosic biomass, a renewable feedstock, but one that is highly challenging to process. Ionic liquids (ILs) are able to solubilize biomass and, in the presence of catalysts, convert the biomass into useful platform chemicals. Herein, we demonstrate that mixtures of ILs are powerful systems for the selective catalytic transformation of cellulose into 5-hydroxymethylfurfural (HMF). Combining ILs with continuous HMF extraction into methyl-isobutyl ketone or 1,2-dimethoxyethane, which form a biphase with the IL mixture, allows the online separation of HMF in high yield. This one-step process is operated under relatively mild conditions and represents a significant step forward towards sustainable HMF production.

  19. Eco-friendly gas mixtures for Resistive Plate Chambers based on Tetrafluoropropene and Helium

    CERN Document Server

    Abbrescia, M; Bianco, S; Ferrini, M; Muhammad, S; Passamonti, L; Pierluigi, D; Piccolo, D; Primavera, F; Russo, A; Saviano, G

    2016-01-01

    Due to the recent restrictions deriving from the application of the Kyoto protocol, the main components of the gas mixtures presently used in the Resistive Plate Chambers systems of the LHC experiments will be most probably phased out of production in the coming years. Identifying possible replacements with the adequate characteristics requires an intense R&D, which was recently started, also in collaborations across the various experiments. Possible candidates have been proposed and are thoroughly investigated. Some tests on one of the most promising candidate - HFO-1234ze, an allotropic form of tetrafluoropropane- have already been reported. Here an innovative approach, based on the use of Helium, to solve the problems related to the too elevate operating voltage of HFO-1234ze based gas mixtures, is discussed and the relative first results are shown.

  20. Eco-friendly gas mixtures for Resistive Plate Chambers based on tetrafluoropropene and Helium

    Science.gov (United States)

    Abbrescia, M.; Benussi, L.; Piccolo, D.; Bianco, S.; Ferrini, M.; Muhammad, S.; Passamonti, L.; Pierluigi, D.; Piccolo, D.; Primavera, F.; Russo, A.; Saviano, G.

    2016-08-01

    Due to the recent restrictions deriving from the application of the Kyoto protocol, the main components of the gas mixtures presently used in the Resistive Plate Chambers systems of the LHC experiments will be most probably phased out of production in the coming years. Identifying possible replacements with the adequate characteristics requires an intense R&D activity, which was recently started, in collaborations with various experiments. Possible new gases have been proposed and are thoroughly investigated. Some tests on one of the most promising candidate—HFO-1234ze, an allotropic form of tetrafluoropropane—have already been reported. Here an innovative approach, based on the use of Helium, to solve the problem related to the high operating voltage needed to operate the chambers with HFO-1234ze based gas mixtures, is discussed and the first results are shown.

  1. Exact inhomogeneous cosmologies whose source is a radiation-matter mixture with consistent thermodynamics

    CERN Document Server

    Sussman, R A; Sussman, Roberto A.; Pavon, Diego

    1999-01-01

    We derive a new class of exact solutions of Einstein's equations providing a physically plausible hydrodynamical description of cosmological matter in the radiative era ($10^6 K > T > 10^3 K$), between nucleosynthesis and decoupling. The solutions are characterized by the Lemaître-Tolman -Bondi metric with a viscous fluid source, subjected to the following conditions: (a) the equilibrium state variables satisfy the equation of state of a mixture of an ultra-relativistic and a non-relativistic ideal gases, where the internal energy of the latter has been neglected, (b) the particle numbers of the mixture components are independently conserved, (c) the viscous stress is consistent with the transport equation and entropy balance law of Extended Irreversible Thermodynamics, with the coefficient of shear viscosity provided by Kinetic Theory for the `radiative gas' model. The fulfilment of (a), (b) and (c) restricts initial conditions in terms of an initial value function, fluctuations of photon entropy per baryon...

  2. Thermodynamic study of binary mixtures containing 1-butylpyridinium tetrafluoroborate and methanol, or ethanol

    Energy Technology Data Exchange (ETDEWEB)

    Garcia-Mardones, M.; Perez-Gregorio, V.; Guerrero, H.; Bandres, I. [Departamento de Quimica Organica-Quimica Fisica, Facultad de Ciencias, Universidad de Zaragoza, 50009 Zaragoza (Spain); Lafuente, C., E-mail: celadi@unizar.e [Departamento de Quimica Organica-Quimica Fisica, Facultad de Ciencias, Universidad de Zaragoza, 50009 Zaragoza (Spain)

    2010-12-15

    Densities and speeds of sound have been determined for the binary mixture (1-butylpyridinium tetrafluoroborate + methanol, or ethanol) over the temperature range 293.15 K to 323.15 K. From experimental values, excess volume and excess isentropic compressibility have been calculated. The mixtures give negative values for the excess properties. Besides, (vapour + liquid) equilibrium in isothermal conditions has been obtained for these systems at T = 303.15 K and T = 323.15 K, which has allowed us to derive activity coefficients and excess Gibbs functions. Positive deviations from Raoult's law have been found. A detailed analysis and interpretation of results have been carried out in structural and energetic terms using thermodynamic information of the pure compounds.

  3. Thermochemical recycling of mixture of scrap tyres and waste lubricating oil into high caloric value products

    Energy Technology Data Exchange (ETDEWEB)

    Abdul-Raouf, Manar E.; Maysour, Nermine E.; Abdul-Azim, Abdul-Azim A. [Egyptian Petroleum Research Institute, Nasr City, Cairo (Egypt); Amin, Mahasen S. [Faculty of Science, Benha University, Benha (Egypt)

    2010-06-15

    Scrap tyres and used lubricating oils represent together growing environmental problem because they are not biodegradable and their components cannot readily be recovered. In the present investigation, the thermochemical recycling of mixture of old tyres with waste lubricating oil by pyrolysis and the value of the products obtained have been studied. First, thermobalance experiments were carried out, studying the influence of the following variables: temperature, type of catalyst and catalyst concentration on the pyrolysis reaction of a mixture of 1/1 wt./wt. oil/tyre ratio. These thermobalance results were thoroughly investigated to study the effect of the main process variables on yields of derived products: oils, gases and solid residue. (author)

  4. Physicochemical analysis and nonisothermal kinetic study of sertraline–lactose binary mixtures

    Directory of Open Access Journals (Sweden)

    Faranak Ghaderi

    2017-07-01

    Full Text Available In the present study the physicochemical stability of sertraline with lactose was evaluated in drug-excipient binary mixtures. Different physicochemical methods such as differential scanning calorimetry (DSC, Fourier-transform infrared spectroscopy, and mass spectrometry were applied to confirm the incompatibility. The final aim of this study was to evaluate the kinetic parameters using a fast and sensitive DSC method. Solid-state kinetic parameters were derived from nonisothermally stressed physical mixtures using different thermal models such as Friedman, Flynn–Wall–Ozawa, and Kissinger–Akahira–Sunose. Overall, the instability of sertraline with lactose was successfully evaluated. Further confirmation was made by tracking the Maillard reaction product of sertraline and lactose by mass spectrometry. DSC scans provided important information about the stability of sertraline in solid-state condition and also revealed the related thermokinetic parameters in order to understand the nature of the chemical instability.

  5. Communication: Virial coefficients and demixing in highly asymmetric binary additive hard-sphere mixtures.

    Science.gov (United States)

    López de Haro, Mariano; Tejero, Carlos F; Santos, Andrés

    2013-04-28

    The problem of demixing in a binary fluid mixture of highly asymmetric additive hard spheres is revisited. A comparison is presented between the results derived previously using truncated virial expansions for three finite size ratios with those that one obtains with the same approach in the extreme case in which one of the components consists of point particles. Since this latter system is known not to exhibit fluid-fluid segregation, the similarity observed for the behavior of the critical constants arising in the truncated series in all instances, while not being conclusive, may cast serious doubts as to the actual existence of a demixing fluid-fluid transition in disparate-sized binary additive hard-sphere mixtures.

  6. Tracer diffusion of hard-sphere binary mixtures under nano-confinement

    Science.gov (United States)

    Marini Bettolo Marconi, Umberto; Malgaretti, Paolo; Pagonabarraga, Ignacio

    2015-11-01

    The physics of diffusion phenomena in nano- and microchannels has attracted a lot of attention in recent years, due to its close connection with many technological, medical, and industrial applications. In the present paper, we employ a kinetic approach to investigate how the confinement in nanostructured geometries affects the diffusive properties of fluid mixtures and leads to the appearance of properties different from those of bulk systems. In particular, we derive an expression for the friction tensor in the case of a bulk fluid mixture confined to a narrow slit having undulated walls. The boundary roughness leads to a new mechanism for transverse diffusion and can even lead to an effective diffusion along the channel larger than the one corresponding to a planar channel of equivalent section. Finally, we discuss a reduction of the previous equation to a one dimensional effective diffusion equation in which an entropic term encapsulates the geometrical information on the channel shape.

  7. Nuclear fuel alloys or mixtures and method of making thereof

    Science.gov (United States)

    Mariani, Robert Dominick; Porter, Douglas Lloyd

    2016-04-05

    Nuclear fuel alloys or mixtures and methods of making nuclear fuel mixtures are provided. Pseudo-binary actinide-M fuel mixtures form alloys and exhibit: body-centered cubic solid phases at low temperatures; high solidus temperatures; and/or minimal or no reaction or inter-diffusion with steel and other cladding materials. Methods described herein through metallurgical and thermodynamics advancements guide the selection of amounts of fuel mixture components by use of phase diagrams. Weight percentages for components of a metallic additive to an actinide fuel are selected in a solid phase region of an isothermal phase diagram taken at a temperature below an upper temperature limit for the resulting fuel mixture in reactor use. Fuel mixtures include uranium-molybdenum-tungsten, uranium-molybdenum-tantalum, molybdenum-titanium-zirconium, and uranium-molybdenum-titanium systems.

  8. Maximum likelihood estimation of finite mixture model for economic data

    Science.gov (United States)

    Phoong, Seuk-Yen; Ismail, Mohd Tahir

    2014-06-01

    Finite mixture model is a mixture model with finite-dimension. This models are provides a natural representation of heterogeneity in a finite number of latent classes. In addition, finite mixture models also known as latent class models or unsupervised learning models. Recently, maximum likelihood estimation fitted finite mixture models has greatly drawn statistician's attention. The main reason is because maximum likelihood estimation is a powerful statistical method which provides consistent findings as the sample sizes increases to infinity. Thus, the application of maximum likelihood estimation is used to fit finite mixture model in the present paper in order to explore the relationship between nonlinear economic data. In this paper, a two-component normal mixture model is fitted by maximum likelihood estimation in order to investigate the relationship among stock market price and rubber price for sampled countries. Results described that there is a negative effect among rubber price and stock market price for Malaysia, Thailand, Philippines and Indonesia.

  9. A new technique for spectrophotometric determination of pseudoephedrine and guaifenesin in syrup and synthetic mixture.

    Science.gov (United States)

    Riahi, Siavash; Hadiloo, Farshad; Milani, Seyed Mohammad R; Davarkhah, Nazila; Ganjali, Mohammad R; Norouzi, Parviz; Seyfi, Payam

    2011-05-01

    The accuracy in predicting different chemometric methods was compared when applied on ordinary UV spectra and first order derivative spectra. Principal component regression (PCR) and partial least squares with one dependent variable (PLS1) and two dependent variables (PLS2) were applied on spectral data of pharmaceutical formula containing pseudoephedrine (PDP) and guaifenesin (GFN). The ability to derivative in resolved overlapping spectra chloropheniramine maleate was evaluated when multivariate methods are adopted for analysis of two component mixtures without using any chemical pretreatment. The chemometrics models were tested on an external validation dataset and finally applied to the analysis of pharmaceuticals. Significant advantages were found in analysis of the real samples when the calibration models from derivative spectra were used. It should also be mentioned that the proposed method is a simple and rapid way requiring no preliminary separation steps and can be used easily for the analysis of these compounds, especially in quality control laboratories. Copyright © 2011 John Wiley & Sons, Ltd.

  10. DURABILITY OF ASPHALT CONCRETE MIXTURES USING DOLOMITE AGGREGATES

    Directory of Open Access Journals (Sweden)

    Imad Al-Shalout

    2015-12-01

    Full Text Available This study deals with the durability of asphalt concrete, including the effects of different gradations, compaction temperatures and immersion time on the durability potential of mixtures. The specific objectives of this study are: to investigate the effect of compaction temperature on the mechanical properties of asphalt concrete mixtures; investigate the effect of bitumen content and different aggregate gradations on the durability potential of bituminous mixtures.

  11. Antiandrogenic activity of phthalate mixtures: Validity of concentration addition

    Energy Technology Data Exchange (ETDEWEB)

    Christen, Verena [University of Applied Sciences Northwestern Switzerland, School of Life Sciences, Gründenstrasse 40, CH-4132 Muttenz (Switzerland); Crettaz, Pierre; Oberli-Schrämmli, Aurelia [Swiss Federal Office of Public Health, Division Chemical Products, 3003 Bern (Switzerland); Fent, Karl, E-mail: karl.fent@bluewin.ch [University of Applied Sciences Northwestern Switzerland, School of Life Sciences, Gründenstrasse 40, CH-4132 Muttenz (Switzerland); Swiss Federal Institute of Technology Zürich (ETH Zürich), Department of Environmental Sciences, 8092 Zürich (Switzerland)

    2012-03-01

    Phthalates and bisphenol A have very widespread use leading to significant exposure of humans. They are suspected to interfere with the endocrine system, including the androgen, estrogen and the thyroid hormone system. Here we analyzed the antiandrogenic activity of six binary, and one ternary mixture of phthalates exhibiting complete antiandrogenic dose–response curves, and binary mixtures of phthalates and bisphenol A at equi-effective concentrations of EC{sub 10}, EC{sub 25} and EC{sub 50} in MDA-kb2 cells. Mixture activity followed the concentration addition (CA) model with a tendency to synergism at high and antagonism at low concentrations. Isoboles and the toxic unit approach (TUA) confirmed the additive to synergistic activity of the binary mixtures BBP + DBP, DBP + DEP and DEP + BPA at high concentrations. Both methods indicate a tendency to antagonism for the EC{sub 10} mixtures BBP + DBP, BBP + DEP and DBP + DEP, and the EC{sub 25} mixture of DBP + BPA. A ternary mixture revealed synergism at the EC{sub 50}, and weak antagonistic activity at the EC{sub 25} level by the TUA. A mixture of five phthalates representing a human urine composition and reflecting exposure to corresponding parent compounds showed no antiandrogenic activity. Our study demonstrates that CA is an appropriate concept to account for mixture effects of antiandrogenic phthalates and bisphenol A. The interaction indicates a departure from additivity to antagonism at low concentrations, probably due to interaction with the androgen receptor and/or cofactors. This study emphasizes that a risk assessment of phthalates should account for mixture effects by applying the CA concept. -- Highlights: ► Antiandrogenic activity of mixtures of 2 and 3 phthalates are assessed in MDA-kb2 cells. ► Mixture activities followed the concentration addition model. ► A tendency to synergism at high and antagonism at low levels occurred.

  12. Determination of thermal conductivity in foundry mould mixtures

    Directory of Open Access Journals (Sweden)

    G. Solenički

    2010-01-01

    Full Text Available For a thorough understanding of the behaviour of foundry mould mixtures, a good knowledge of thermal properties of mould materials is needed. Laboratory determination of thermal conductivity of mould mixtures enables a better control over scabbing defects which are a major problem in green sand mould mixtures. A special instrument has been designed for that purpose and it is described in this work.

  13. Tails assumptions and posterior concentration rates for mixtures of Gaussians

    OpenAIRE

    Naulet, Zacharie; Rousseau, Judith

    2016-01-01

    Nowadays in density estimation, posterior rates of convergence for location and location-scale mixtures of Gaussians are only known under light-tail assumptions; with better rates achieved by location mixtures. It is conjectured, but not proved, that the situation should be reversed under heavy tails assumptions. The conjecture is based on the feeling that there is no need to achieve a good order of approximation in regions with few data (say, in the tails), favoring location-scale mixtures w...

  14. Constrained Fisher Scoring for a Mixture of Factor Analyzers

    Science.gov (United States)

    2016-09-01

    global appearance model across the entire sensor network. constrained maximum likelihood estimation, mixture of factor analyzers, Newton’s method...ARL-TR-7836• SEP 2016 US Army Research Laboratory Constrained Fisher Scoring for a Mixture of Factor Analyzers by Gene T Whipps, Emre Ertin, and...TR-7836• SEP 2016 US Army Research Laboratory Constrained Fisher Scoring for a Mixture of Factor Analyzers by Gene T Whipps Sensors and Electron

  15. Experimental and Numerical Investigation of Ethanol/Diethyl Ether Mixtures in a CI Engine

    KAUST Repository

    Sivasankaralingam, Vedharaj

    2016-10-17

    The auto-ignition characteristics of diethyl ether (DEE)/ethanol mixtures are investigated in compression ignition (CI) engines both numerically and experimentally. While DEE has a higher derived cetane number (DCN) of 139, ethanol exhibits poor ignition characteristics with a DCN of 8. DEE was used as an ignition promoter for the operation of ethanol in a CI engine. Mixtures of DEE and ethanol (DE), i.e., DE75 (75% DEE + 25% ethanol), DE50 (50% DEE + 50% ethanol) and DE25 (25% DEE + 75% ethanol), were tested in a CI engine. While DE75 and DE50 auto-ignited at an inlet air pressure of 1.5 bar, DE25 failed to auto-ignite even at boosted pressure of 2 bar. The peak in-cylinder pressure for diesel and DE75 were comparable, while DE50 showed reduced peak in-cylinder pressure with delayed start of combustion (SOC). Numerical simulations were conducted to study the engine combustion characteristics of DE mixture. A comprehensive detailed chemical kinetic model was created to represent the combustion of DE mixtures. The detailed mechanism was then reduced using standard direct relation graph (DRG-X) method and coupled with 3D CFD code, CONVERGE, to simulate the experimental data. The simulation results showed that the effects of physical properties on DE50 combustion are negligible. Simulations of DE50 mixture revealed that the combustion is nearly homogenous, while diesel (n-heptane used as a surrogate) and DE75 showed similar combustion behavior with flame liftoff and diffusion controlled combustion. Diesel exhibited auto-ignition at an equivalence ratio of 2, while DE75 and DE50 showed auto-ignition in the equivalence ratio range of 1-1.5 and 0-1, respectively. The experiments and numerical simulations demonstrate how the high reactivity of DEE supports the auto-ignition of ethanol, while ethanol acts as a radical scavenger.

  16. From single chemicals to mixtures--reproductive effects of levonorgestrel and ethinylestradiol on the fathead minnow.

    Science.gov (United States)

    Runnalls, Tamsin J; Beresford, Nicola; Kugathas, Subramaniam; Margiotta-Casaluci, Luigi; Scholze, Martin; Scott, Alexander P; Sumpter, John P

    2015-12-01

    The aquatic environment is polluted with thousands of chemicals. It is currently unclear which of these pose a significant threat to aquatic biota. The typical exposure scenario is now represented by a widespread blanket of contamination composed of myriads of individual pollutants-each typically present at a low concentration. The synthetic steroids, 17α-ethinylestradiol and levonorgestrel, have been widely reported to be present in the aquatic environment in the low ng to sub-ng/l range. They are widely used in contraceptive formulations, both individually and in combination. Our research employed the fathead minnow (Pimephales promelas) 21 day 'pair-breeding' assay to assess reproductive output when pairs of fish were exposed to the single chemicals at low environmentally relevant concentrations, and then to a binary mixture of them. A variety of endpoints were assessed, including egg production, which was inhibited in a concentration-dependent manner by both the individual chemicals and the mixture. Significant, sex specific effects were also seen with both chemicals, at differing levels of biological organisation. Plasma concentrations of EE2 and levonorgestrel were predicted and in the case of levonorgestrel measured, and compared with the human therapeutic plasma concentrations (Read-Across approach) to support the interpretation of the results. A novel quantitative method was developed for the data analysis, which ensured a suitable endpoint for the comparative mixture assessment. This approach compares the reproductive performance from individual pairs of fish during chemical exposure to its pre-treatment performance. The responses from the empirical mixture study were compared to predictions derived from the single substance data. We hypothesised combined responses which were best described by the concept of concentration addition, and found no clear indications against this additivity expectation. However, the effect profiles support the current

  17. Spectroscopic and Chemometric Analysis of Binary and Ternary Edible Oil Mixtures: Qualitative and Quantitative Study.

    Science.gov (United States)

    Jović, Ozren; Smolić, Tomislav; Primožič, Ines; Hrenar, Tomica

    2016-04-19

    The aim of this study was to investigate the feasibility of FTIR-ATR spectroscopy coupled with the multivariate numerical methodology for qualitative and quantitative analysis of binary and ternary edible oil mixtures. Four pure oils (extra virgin olive oil, high oleic sunflower oil, rapeseed oil, and sunflower oil), as well as their 54 binary and 108 ternary mixtures, were analyzed using FTIR-ATR spectroscopy in combination with principal component and discriminant analysis, partial least-squares, and principal component regression. It was found that the composition of all 166 samples can be excellently represented using only the first three principal components describing 98.29% of total variance in the selected spectral range (3035-2989, 1170-1140, 1120-1100, 1093-1047, and 930-890 cm(-1)). Factor scores in 3D space spanned by these three principal components form a tetrahedral-like arrangement: pure oils being at the vertices, binary mixtures at the edges, and ternary mixtures on the faces of a tetrahedron. To confirm the validity of results, we applied several cross-validation methods. Quantitative analysis was performed by minimization of root-mean-square error of cross-validation values regarding the spectral range, derivative order, and choice of method (partial least-squares or principal component regression), which resulted in excellent predictions for test sets (R(2) > 0.99 in all cases). Additionally, experimentally more demanding gas chromatography analysis of fatty acid content was carried out for all specimens, confirming the results obtained by FTIR-ATR coupled with principal component analysis. However, FTIR-ATR provided a considerably better model for prediction of mixture composition than gas chromatography, especially for high oleic sunflower oil.

  18. Interest rate derivatives

    DEFF Research Database (Denmark)

    Svenstrup, Mikkel

    This Ph.D. thesis consists of four self-contained essays on valuation of interest rate derivatives. In particular derivatives related to management of interest rate risk care are considered.......This Ph.D. thesis consists of four self-contained essays on valuation of interest rate derivatives. In particular derivatives related to management of interest rate risk care are considered....

  19. Mixtures of conditional Gaussian scale mixtures applied to multiscale image representations.

    Directory of Open Access Journals (Sweden)

    Lucas Theis

    Full Text Available We present a probabilistic model for natural images that is based on mixtures of Gaussian scale mixtures and a simple multiscale representation. We show that it is able to generate images with interesting higher-order correlations when trained on natural images or samples from an occlusion-based model. More importantly, our multiscale model allows for a principled evaluation. While it is easy to generate visually appealing images, we demonstrate that our model also yields the best performance reported to date when evaluated with respect to the cross-entropy rate, a measure tightly linked to the average log-likelihood. The ability to quantitatively evaluate our model differentiates it from other multiscale models, for which evaluation of these kinds of measures is usually intractable.

  20. Use of multiline cultivars and cultivar mixtures for disease management.

    Science.gov (United States)

    Mundt, C C

    2002-01-01

    The usefulness of mixtures (multiline cultivars and cultivar mixtures) for disease management has been well demonstrated for rusts and powdery mildews of small grain crops. Such mixtures are more useful under some epidemiological conditions than under others, and experimental methodology, especially problems of scale, may be crucial in evaluating the potential efficacy of mixtures on disease. There are now examples of mixtures providing both low and high degrees of disease control for a wide range of pathosystems, including crops with large plants, and pathogens that demonstrate low host specificity, or are splash dispersed, soilborne, or insect vectored. Though most analyses of pathogen evolution in mixtures consider static costs of virulence to be the main mechanism countering selection for pathogen complexity, many other potential mechanisms need to be investigated. Agronomic and marketing considerations must be carefully evaluated when implementing mixture approaches to crop management. Practical difficulties associated with mixtures have often been overestimated, however, and mixtures will likely play an increasingly important role as we develop more sustainable agricultural systems.

  1. UTILIZATION OF WASTE PLASTIC BOTTLES IN ASPHALT MIXTURE

    Directory of Open Access Journals (Sweden)

    TAHER BAGHAEE MOGHADDAM

    2013-06-01

    Full Text Available Nowadays, large amounts of waste materials are being produced in the world. One of the waste materials is plastic bottle. Generating disposable plastic bottles is becoming a major problem in many countries. Using waste plastic as a secondary material in construction projects would be a solution to overcome the crisis of producing large amount of waste plastics in one hand and improving the structure’s characteristics such as resistance against cracking on the other hand. This study aimed to investigate the effects of adding plastic bottles in road pavement. Marshall properties as well as specific gravity of asphalt mixture containing different percentages of plastic bottles were evaluated. Besides, Optimum Asphalt Content (OAC was calculated for each percentages of plastic bottles used in the mix. The stiffness and fatigue characteristics of mixture were assessed at OAC value. Results showed that the stability and flow values of asphalt mixture increased by adding waste crushed plastic bottle into the asphalt mixture. Further, it was shown that the bulk specific gravity and stiffness of mixtures increased by adding lower amount of plastic bottles; however, adding higher amounts of plastic resulted in lower specific gravity and mix stiffness. In addition, it was concluded that the mixtures containing waste plastic bottles have lower OAC values compared to the conventional mixture, and this may reduce the amount of asphalt binder can be used in road construction projects. Besides, the mixtures containing waste plastic showed significantly greater fatigue resistance than the conventional mixture.

  2. [Construction of Three-Dimensional Isobologram for Ternary Pollutant Mixtures].

    Science.gov (United States)

    2015-12-01

    Tongji University, Shanghai 200092, China) Isobolographic analysis was widely used in the interaction assessment of binary mixtures. However, how to construct a three-dimensional (3D) isobologram for the assessment of toxicity interaction within ternary mixtures is still not reported up to date. The main purpose of this paper is to develop a 3D isobologram where the relative concentrations of three components are acted as three coordinate axes in 3D space to examine the toxicity interaction within ternary mixtures. Taking six commonly used pesticides in China, including three herbicides (2, 4-D, desmetryne and simetryn) and three insecticides ( dimethoate, imidacloprid and propoxur) as the mixture components, the uniform design ray procedure (UD-Ray) was used to rationally design the concentration composition of various components in the ternary mixtures so that effectively and comprehensively reflected the variety of actual environmental concentrations. The luminescent inhibition toxicities of single pesticides and their ternary mixtures to Vibrio fischeri at various concentration levels were determined by the microplate toxicity analysis. Selecting concentration addition (CA) as the addition reference, 3D isobolograms were constructed to study the toxicity interactions of various ternary mixtures. The results showed that the 3D isobologram could clearly and directly exhibit the toxicity interactions of ternary mixtures, and extend the use of isobolographic analysis into the ternary mixtures.

  3. Calculation and Analysis of Mean Opacity of Gold Mixtures

    Institute of Scientific and Technical Information of China (English)

    YAN An-ying; JIANG Ming; CHENG Xin-lu; YANG Xiang-dong

    2007-01-01

    A screened hydrogenic model for l splitting (SHML) is used to calculate the Rosseland mean opacities of high-Z Au, Ta, Yb, Ho, Gd, Sm, Nd, Sn, Ag plasmas and mixtures of gold and these elements at high temperature (T=200-400eV) and dense (ρ=1g/cm3).From the calculated Rosseland mean opacities of the mixtures, Au-Nd seems to be a better choice than other mixtures.Simultaneously, the reason that the mean opacities of mixture of Au-Sn decrease slightly when T=400eV is analyzed.

  4. Swelling characteristics of immersed sand-bentonite mixtures

    Institute of Scientific and Technical Information of China (English)

    丰土根; 崔红斌; 孙德安; 杜冰

    2008-01-01

    A laboratory one-dimensional consolidation apparatus was employed to research the swelling stress and volume of the sand-bentonite mixture under immersed conditions. The stress-strain characteristics of mixtures under varied mixing ratios and loading statuses were analyzed. Based on the results of tests, the mechanism of mixture swelling and collapsing was further discussed. The results show that mixtures with low sand ratios are suitable as hydraulic barrier or containment barriers of general landfills, geological repository and other hydraulic infrastructure works.

  5. Physical Stability of Freeze-Dried Isomalt Diastereomer Mixtures

    DEFF Research Database (Denmark)

    Koskinen, Anna-Kaisa; Fraser-Miller, Sara J.; Bøtker, Johan P.

    2016-01-01

    of the diastereomer compositions showed signs of physical instability when stored in the highest relative humidity condition. The four different crystalline diastereomer mixtures showed specific identifiable solid state properties. Conclusions Isomalt was shown to be a suitable excipient for freeze-drying. Preferably...... a mixture of the diastereomers should be used, as the mixture containing only one of the isomers showed physical instability. A mixture containing a 1:1 ratio of the two diastereomers showed the best physical stability in the amorphous form....

  6. Opacity Calculations for Non-Local Thermodynamic Equilibrium Mixtures

    Institute of Scientific and Technical Information of China (English)

    吴泽清; 韩国兴; 逄锦桥

    2002-01-01

    Based on the average atom model, a non-local thermodynamic equilibrium (non-LTE) model is developed to calculate opacity for mixtures. This model could be applied to high-Z problems. The mean ionization degrees of SiO2 of the present calculation are slightly higher compared with another model for mixtures. As an example, the opacity of Au and Nd mixture is calculated. The results show concrete non-LTE effects and the increase in opacity of the mixture is shown clearly.

  7. Moisture sensitivity examination of asphalt mixtures using thermodynamic, direct adhesion peel and compacted mixture mechanical tests

    OpenAIRE

    Zhang, Jizhe; AIREY, Gordon D; Grenfell, James; Apeagyei, Alex K.

    2016-01-01

    Moisture damage in asphalt mixtures is a complicated mode of pavement distress that results in the loss of stiffness and structural strength of the asphalt pavement layers. This paper evaluated the moisture sensitivity of different aggregate–bitumen combinations through three different approaches: surface energy, peel adhesion and the Saturation Ageing Tensile Stiffness (SATS) tests. In addition, the results obtained from these three tests were compared so as to characterise the relationship ...

  8. Incorporating Endmember Variability into Spectral Mixture Analysis Through Endmember Bundles

    Science.gov (United States)

    Bateson, C. Ann; Asner, Gregory P.; Wessman, Carol A.

    1998-01-01

    Variation in canopy structure and biochemistry induces a concomitant variation in the top-of-canopy spectral reflectance of a vegetation type. Hence, the use of a single endmember spectrum to track the fractional abundance of a given vegetation cover in a hyperspectral image may result in fractions with considerable error. One solution to the problem of endmember variability is to increase the number of endmembers used in a spectral mixture analysis of the image. For example, there could be several tree endmembers in the analysis because of differences in leaf area index (LAI) and multiple scatterings between leaves and stems. However, it is often difficult in terms of computer or human interaction time to select more than six or seven endmembers and any non-removable noise, as well as the number of uncorrelated bands in the image, limits the number of endmembers that can be discriminated. Moreover, as endmembers proliferate, their interpretation becomes increasingly difficult and often applications simply need the aerial fractions of a few land cover components which comprise most of the scene. In order to incorporate endmember variability into spectral mixture analysis, we propose representing a landscape component type not with one endmember spectrum but with a set or bundle of spectra, each of which is feasible as the spectrum of an instance of the component (e.g., in the case of a tree component, each spectrum could reasonably be the spectral reflectance of a tree canopy). These endmember bundles can be used with nonlinear optimization algorithms to find upper and lower bounds on endmember fractions. This approach to endmember variability naturally evolved from previous work in deriving endmembers from the data itself by fitting a triangle, tetrahedron or, more generally, a simplex to the data cloud reduced in dimension by a principal component analysis. Conceptually, endmember variability could make it difficult to find a simplex that both surrounds the data

  9. Porous concrete mixtures for pervious urban pavements

    Directory of Open Access Journals (Sweden)

    Castro, J.

    2007-08-01

    Full Text Available The present study aimed to analyze the hydraulic and mechanical behaviour of a series of roller-compacted, laboratory porous concrete mixtures. The mix design variables examined were the actual void ratio in the hardened concrete and the water/cement ratio. From these results the better dosages from the mechanical and hydraulical behaviour point of view were determined. One of the designs developed was found to exhibit excellent hydraulic capacity and 20% greater strength than the mixtures recommended in the literature. Moreover, concrete with an actual void ratio of only 14% was observed to meet permeability requirements. Maximum flexural strength of concretes with different w/c ratios was achieved with a cement paste content of 250 l/m3. Relationships were found between the void ratio and both 28-day concrete permeability and flexural strength. Finally, the doses exhibiting the best mechanical and hydraulic performance were identified.El trabajo realizado en este estudio consistió en analizar el comportamiento de diferentes dosificaciones de mezclas de hormigón poroso, fabricadas en laboratorio y compactadas con rodillo pesado para simular las condiciones de terreno. Las variables consideradas para el diseño de las mezclas fueron el porcentaje real de huecos en el hormigón endurecido y la razón agua/cemento. A partir de estos resultados se determinaron las dosificaciones que presentan mejor comportamiento desde el punto de vista mecánico e hidráulico. Los resultados muestran que existe una dosificación de hormigón poroso, distinta a las encontradas actualmente en la literatura internacional, que permite obtener resistencias hasta 20% más altas, manteniendo todavía una excelente capacidad hidráulica. Se determinó que una permeabilidad suficiente se puede obtener con un porcentaje real de huecos de 14%, y que agregar pasta de cemento en una proporción de 250 l/m3 permite maximizar la resistencia a flexotracción de hormigones que

  10. Monte Carlo neutral particle transport through a binary stochastic mixture using chord length sampling

    Science.gov (United States)

    Donovan, Timothy J.

    A Monte Carlo algorithm is developed to estimate the ensemble-averaged behavior of neutral particles within a binary stochastic mixture. A special case stochastic mixture is examined, in which non-overlapping spheres of constant radius are uniformly mixed in a matrix material. Spheres are chosen to represent the stochastic volumes due to their geometric simplicity and because spheres are a common approximation to a large number of applications. The boundaries of the mixture are impenetrable, meaning that spheres in the stochastic mixture cannot be assumed to overlap the mixture boundaries. The algorithm employs a method called Limited Chord Length Sampling (LCLS). While in the matrix material, LCLS uses chord-length sampling to sample the distance to the next stochastic interface. After a surface crossing into a stochastic sphere, transport is treated explicitly until the particle exits or is killed. This capability eliminates the need to explicitly model a representation of the random geometry of the mixture. The algorithm is first proposed and tested against benchmark results for a two dimensional, fixed source model using stand-alone Monte Carlo codes. The algorithm is then implemented and tested in a test version of the Los Alamos M&barbelow;onte C&barbelow;arlo ṉ-p&barbelow;article Code MCNP. This prototype MCNP version has the capability to calculate LCLS results for both fixed source and multiplied source (i.e., eigenvalue) problems. Problems analyzed with MCNP range from simple binary mixtures, designed to test LCLS over a range of optical thicknesses, to a detailed High Temperature Gas Reactor fuel element, which tests the value of LCLS in a current problem of practical significance. Comparisons of LCLS and benchmark results include both accuracy and efficiency comparisons. To ensure conservative efficiency comparisons, the statistical basis for the benchmark technique is derived and a formal method for optimizing the benchmark calculations is developed

  11. Derivative properties from high-precision equations of state.

    Science.gov (United States)

    Haghbakhsh, Reza; Konttorp, Morten; Raeissi, Sona; Peters, Cor J; O'Connell, John P

    2014-12-11

    In this study, the behavior of derivative properties estimated by equations of state, including isochoric heat capacity, isobaric heat capacity, speed of sound, and the Joule-Thomson coefficient for pure compounds and a mixture, has been investigated. The Schmidt-Wagner and Jacobsen-Stewart equations of state were used for predictions of derivative properties of 10 different pure compounds from various nonpolar hydrocarbons, nonpolar cyclic hydrocarbons, polar compounds, and refrigerants. The estimations were compared to experimental data. To evaluate the behavior of mixtures, the extended corresponding states principle (ECS) was studied. Analytical relationships were derived for isochoric heat capacity, isobaric heat capacity, the Joule-Thomson coefficient, and the speed of sound. The ECS calculations were compared to the reference surface data of methane + ethane. The ECS principle was found to generate data of high quality.

  12. Attempt at determining selected parameters of gravitational transport of ash and water or ash-brine mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Postawa, J.

    1984-03-01

    This paper discusses results of laboratory investigations into hydraulic transport of hardening mixtures which are used for stowing in underground coal mines in Poland. Two types of hardening mixtures are used: fly ash from the Jaworzno I power plant or the Leg power plant and water or fly ash and brine. The following proportions of fly ash and water are used: 1.5:1, 2:1, 2.5:1 and 3.0:1. Proportion of fly ash and brine ranges from 1.5:1 to 2.5:1. Critical transport velocity of mixtures depending on physical properties of fly ash, proportion of fly ash and water or brine and pipeline diameter is determined. Equations for calculating the optimum conditions of hydraulic transport of hardening stowing are derived. Factors which influence range of hydraulic stowing and stowing efficiency are analyzed. The results of analyses are given in 6 diagrams and 4 tables. (4 refs.) (In Polish)

  13. Spectrophotometric methods for simultaneous determination of ternary mixture of amlodipine besylate, olmesartan medoxomil and hydrochlorothiazide

    Science.gov (United States)

    Merey, Hanan A.; Ramadan, Nesrin K.; Diab, Sherine S.; Moustafa, Azza A.

    Four, accurate, precise, and sensitive spectrophotometric methods are developed for the simultaneous determination of a ternary mixture containing amlodipine besylate (AM), olmesartan medoxomil (OL) and hydrochlorothiazide (HZ), where AM is determined at its λmax 364.6 nm (0D), while (OL) and (HZ) are determined by different methods. Method (A) depends on determining OL and HZ by measuring the second derivative of the ratio spectra (2DD) at 254.4 and 338.6 nm, respectively. Method (B) is first derivative of the double divisor ratio spectra (D-1DD) at 260.4 and 273.0 nm for OL and HZ, respectively. Method (C) based on successive spectrophotometric resolution technique (SSRT). The technique starts with the ratio subtraction method then measuring OL and HZ at their isoabsorptive point at 260.0 nm, while HZ is measured using the amplitude of first derivative at 335.2 nm. Method (D) is mean centering of the ratio spectra (MCR) at 252.0 nm and 220.0 nm for OL and HZ, respectively. The specificity of the developed methods is investigated by analyzing laboratory prepared mixtures containing different ratios of the three drugs and their combined dosage form. The obtained results are statistically compared with those obtained by the official or reported methods, showing no significant difference with respect to accuracy and precision at p = 0.05.

  14. Experimental wax mixtures for dental use.

    Science.gov (United States)

    Kotsiomiti, E; McCabe, J F

    1997-07-01

    Improvements in the properties of dental waxes were sought by alterations in their composition. Twenty-six blends of paraffin wax, beeswax and inorganic filler were subjected to the following tests: plastic deformation (flow), linear thermal expansion, elastic modulus and flexural strength. Flow tests were conducted in accordance with the corresponding ISO specification. Thermal expansion coefficients were estimated using thermomechanical analysis. Mechanical properties were tested using a universal testing machine. Pure paraffin and beeswax were used as controls. The results were subjected to analysis using correlation and regression. Regression coefficients in the range of 0.90-0.99 were obtained in most cases, flow tests exhibiting the highest coefficients and flexural strength the lowest. The incorporated filler particles reduced the flow of the natural waxes, especially of the ester-containing beeswax, and improved the elastic modulus and strength. Good correlation was found between the ingredient proportions and measured properties, suggesting a relationship between them, although this is quite complicated in the case of tertiary wax mixtures. The experimental blends exhibited properties that are potentially useful for a range of clinical applications.

  15. Mixture latent autoregressive models for longitudinal data

    CERN Document Server

    Bartolucci, Francesco; Pennoni, Fulvia

    2011-01-01

    Many relevant statistical and econometric models for the analysis of longitudinal data include a latent process to account for the unobserved heterogeneity between subjects in a dynamic fashion. Such a process may be continuous (typically an AR(1)) or discrete (typically a Markov chain). In this paper, we propose a model for longitudinal data which is based on a mixture of AR(1) processes with different means and correlation coefficients, but with equal variances. This model belongs to the class of models based on a continuous latent process, and then it has a natural interpretation in many contexts of application, but it is more flexible than other models in this class, reaching a goodness-of-fit similar to that of a discrete latent process model, with a reduced number of parameters. We show how to perform maximum likelihood estimation of the proposed model by the joint use of an Expectation-Maximisation algorithm and a Newton-Raphson algorithm, implemented by means of recursions developed in the hidden Mark...

  16. Structure of colloidal sphere-plate mixtures

    Science.gov (United States)

    Doshi, N.; Cinacchi, G.; van Duijneveldt, J. S.; Cosgrove, T.; Prescott, S. W.; Grillo, I.; Phipps, J.; Gittins, D. I.

    2011-05-01

    In addition to containing spherical pigment particles, coatings usually contain plate-like clay particles. It is thought that these improve the opacity of the paint film by providing an efficient spacing of the pigment particles. This observation is counterintuitive, as suspensions of particles of different shapes and sizes tend to phase separate on increase of concentration. In order to clarify this matter a model colloidal system is studied here, with a sphere-plate diameter ratio similar to that found in paints. For dilute suspensions, small angle neutron scattering revealed that the addition of plates leads to enhanced density fluctuations of the spheres, in agreement with new theoretical predictions. On increasing the total colloid concentration the plates and spheres phase separate due to the disparity in their shape. This is in agreement with previous theoretical and experimental work on colloidal sphere-plate mixtures, where one particle acts as a depleting agent. The fact that no large scale phase separation is observed in coatings is ascribed to dynamic arrest in intimately mixed, or possibly micro-phase separated structures, at elevated concentration.

  17. Mixture modeling approach to flow cytometry data.

    Science.gov (United States)

    Boedigheimer, Michael J; Ferbas, John

    2008-05-01

    Flow Cytometry has become a mainstay technique for measuring fluorescent and physical attributes of single cells in a suspended mixture. These data are reduced during analysis using a manual or semiautomated process of gating. Despite the need to gate data for traditional analyses, it is well recognized that analyst-to-analyst variability can impact the dataset. Moreover, cells of interest can be inadvertently excluded from the gate, and relationships between collected variables may go unappreciated because they were not included in the original analysis plan. A multivariate non-gating technique was developed and implemented that accomplished the same goal as traditional gating while eliminating many weaknesses. The procedure was validated against traditional gating for analysis of circulating B cells in normal donors (n = 20) and persons with Systemic Lupus Erythematosus (n = 42). The method recapitulated relationships in the dataset while providing for an automated and objective assessment of the data. Flow cytometry analyses are amenable to automated analytical techniques that are not predicated on discrete operator-generated gates. Such alternative approaches can remove subjectivity in data analysis, improve efficiency and may ultimately enable construction of large bioinformatics data systems for more sophisticated approaches to hypothesis testing.

  18. Solubility of C60 in solvent mixtures.

    Science.gov (United States)

    Kulkarni, Pradnya P; Jafvert, Chad T

    2008-02-01

    The potential large-scale production of fullerene C60 and its widespread use in consumer products may translate into occupational and public exposure and in long-term environmental exposure. To assess the risk and fate of C60 in the environment, it is important to understand its solvate formation in common industrial solvents as the solvates may affect various properties of C60 including reactivity and toxicity, particularly when solvates occur in C60 clusters. In this study, the solubility measurements in mixed solvent system can provide useful information about solvate formation. The solubility of C60 was measured in pure toluene, tetrahydrofuran, ethanol, and acetonitrile to be 3000, 11, 1.4, and 0.04 mg/L, respectively. Additionally, the solubility of C60 was measured in mixtures of toluene-acetonitrile, toluene-ethanol, toluene-tetrahydrofuran, and acetonitrile-tetrahydrofuran. The solubility data were modeled with some accuracy using Wohl's equation. The estimated crystal energy term for C60 in tetrahydrofuran was different than that in the other solvents, indicating that the C60 solid phase in equilibrium with tetrahydrofuran solution may be a solvated crystal.

  19. Multicomponent mixtures for cryoprotection and ligand solubilization

    Directory of Open Access Journals (Sweden)

    Lidia Ciccone

    2015-09-01

    Full Text Available Mixed cryoprotectants have been developed for the solubilization of ligands for crystallization of protein–ligand complexes and for crystal soaking. Low affinity lead compounds with poor solubility are problematic for structural studies. Complete ligand solubilization is required for co-crystallization and crystal soaking experiments to obtain interpretable electron density maps for the ligand. Mixed cryo-preserving compounds are needed prior to X-ray data collection to reduce radiation damage at synchrotron sources. Here we present dual-use mixes that act as cryoprotectants and also promote the aqueous solubility of hydrophobic ligands. Unlike glycerol that increases protein solubility and can cause crystal melting the mixed solutions of cryo-preserving compounds that include precipitants and solubilizers, allow for worry-free crystal preservation while simultaneously solubilizing relatively hydrophobic ligands, typical of ligands obtained in high-throughput screening. The effectiveness of these mixture has been confirmed on a human transthyretin crystals both during crystallization and in flash freezing of crystals.

  20. Structure of colloidal sphere-plate mixtures

    Energy Technology Data Exchange (ETDEWEB)

    Doshi, N; Cinacchi, G; Van Duijneveldt, J S; Cosgrove, T; Prescott, S W [School of Chemistry, University of Bristol, Bristol BS8 1TS (United Kingdom); Grillo, I [Institut Laue-Langevin, 6 rue Jules Horowitz BP 156, 38042 Grenoble Cedex 9 (France); Phipps, J [Imerys Minerals Ltd, Par Moor Centre, Par Moor Road, Par, Cornwall PL24 2SQ (United Kingdom); Gittins, D I, E-mail: Giorgio.Cinacchi@bristol.ac.uk, E-mail: J.S.van-Duijneveldt@bristol.ac.uk [Imerys Performance and Filtration Minerals Ltd, 130 Castilian Drive, Goleta, CA 93117 (United States)

    2011-05-18

    In addition to containing spherical pigment particles, coatings usually contain plate-like clay particles. It is thought that these improve the opacity of the paint film by providing an efficient spacing of the pigment particles. This observation is counterintuitive, as suspensions of particles of different shapes and sizes tend to phase separate on increase of concentration. In order to clarify this matter a model colloidal system is studied here, with a sphere-plate diameter ratio similar to that found in paints. For dilute suspensions, small angle neutron scattering revealed that the addition of plates leads to enhanced density fluctuations of the spheres, in agreement with new theoretical predictions. On increasing the total colloid concentration the plates and spheres phase separate due to the disparity in their shape. This is in agreement with previous theoretical and experimental work on colloidal sphere-plate mixtures, where one particle acts as a depleting agent. The fact that no large scale phase separation is observed in coatings is ascribed to dynamic arrest in intimately mixed, or possibly micro-phase separated structures, at elevated concentration.

  1. [2+2] Photocycloaddition of [60]Fullerene with Podophyllotoxin Derivative Containing Cyclohexadienone Group

    Institute of Scientific and Technical Information of China (English)

    Qian Rong LI; Li Qun LI; Sha YANG

    2005-01-01

    Photochemical [2+2] cycloaddition of C60 with podophyllotoxin derivative containing a cyclohexadienone group in o-dichlorobenzene afforded an isomeric mixture of adducts and a pure adduct of C60-fused podophyllotoxin derivatives. The structures of the products were characterized by MS, NMR and IR spectra.

  2. Resolution of overlapped spectra for the determination of ternary mixture using different and modified spectrophotometric methods

    Science.gov (United States)

    Moussa, Bahia Abbas; El-Zaher, Asmaa Ahmed; Mahrouse, Marianne Alphonse; Ahmed, Maha Said

    2016-08-01

    Four new spectrophotometric methods were developed, applied to resolve the overlapped spectra of a ternary mixture of [aliskiren hemifumarate (ALS)-amlodipine besylate (AM)-hydrochlorothiazide (HCT)] and to determine the three drugs in pure form and in combined dosage form. Method A depends on simultaneous determination of ALS, AM and HCT using principal component regression and partial least squares chemometric methods. In Method B, a modified isosbestic spectrophotometric method was applied for the determination of the total concentration of ALS and HCT by measuring the absorbance at 274.5 nm (isosbestic point, Aiso). On the other hand, the concentration of HCT in ternary mixture with ALS and AM could be calculated without interference using first derivative spectrophotometric method by measuring the amplitude at 279 nm (zero crossing of ALS and zero value of AM). Thus, the content of ALS was calculated by subtraction. Method C, double divisor first derivative ratio spectrophotometry (double divisor 1DD method), was based on that for the determination of one drug, the ratio spectra were obtained by dividing the absorption spectra of its different concentrations by the sum of the absorption spectra of the other two drugs as a double divisor. The first derivative of the obtained ratio spectra were then recorded using the appropriate smoothing factor. The amplitudes at 291 nm, 380 nm and 274.5 nm were selected for the determination of ALS, AM and HCT in their ternary mixture, respectively. Method D was based on mean centering of ratio spectra. The mean centered values at 287, 295.5 and 269 nm were recorded and used for the determination of ALS, AM and HCT, respectively. The developed methods were validated according to ICH guidelines and proved to be accurate, precise and selective. Satisfactory results were obtained by applying the proposed methods to the analysis of pharmaceutical dosage form.

  3. DESIGNS FOR MIXTURE AND PROCESS VARIABLES APPLIED IN TABLET FORMULATIONS

    NARCIS (Netherlands)

    DUINEVELD, CAA; SMILDE, AK; DOORNBOS, DA

    1993-01-01

    Although there are several methods for the construction of a design for process variables and mixture variables, there are not very many methods which are suitable to combine mixture and process variables in one design. Some of the methods which are feasible will be shown. These methods will be

  4. Toxicological evaluation and risk assessment of chemical mixtures

    NARCIS (Netherlands)

    Cassee, F.R.; Groten, J.P.; Bladeren, P.J. van; Feron, V.J.

    1998-01-01

    A major objective of combination toxicology is to establish whether a mixture of chemicals will result in an effect similar to that expected on the basis of additivity. This requires understanding of the basic concepts of the combined toxicological action of the compounds of the mixture: simple

  5. Learning Mixtures of Polynomials of Conditional Densities from Data

    DEFF Research Database (Denmark)

    L. López-Cruz, Pedro; Nielsen, Thomas Dyhre; Bielza, Concha;

    2013-01-01

    Mixtures of polynomials (MoPs) are a non-parametric density estimation technique for hybrid Bayesian networks with continuous and discrete variables. We propose two methods for learning MoP ap- proximations of conditional densities from data. Both approaches are based on learning MoP approximations......- ods with the approach for learning mixtures of truncated basis functions from data....

  6. Rheological properties of asphalt mixtures containing various fibers

    Institute of Scientific and Technical Information of China (English)

    叶群山; 吴少鹏; 陈筝; 刘至飞

    2008-01-01

    Rheological characteristics of fiber-modified asphalt mixture were investigated.Cellulous fiber,polyester fiber and mineral fiber were used as additives for asphalt mixture,and the dosages were 0.3%,0.3%,0.4%,respectively.Dynamic modulus test using superpave simple performance tester(SPT) was adopted to study the dynamic modulus and phase angle for the control mixture and fiber-modified ones at various temperatures and frequencies.Test results show that the rheological properties can be improved significantly by the addition of various fibers.The dynamic modulus increases with the increase of frequency,and the phase angle decreases with the increase of frequency.When various fibers are used,the dynamic modulus increases and phase angle decreases at each frequency.This indicates that the stiffness and the elastic portion of fiber-modified asphalt mixtures can be enhanced when various fibers are used,which results in the change of viscoelastic properties of mixtures.The creep test results show that the total strain and the permanent strain of asphalt mixtures during load-unload cycle can be significantly reduced,which results in the improvement of resistance to permanent deformation for asphalt mixtures containing various fiber additives.The Burgers model can be employed effectively to illustrate the rheological properties of fiber modified asphalt mixtures.

  7. Predicting Development of an Epidemics on Cultivar Mixtures

    DEFF Research Database (Denmark)

    Østergård, Hanne

    1983-01-01

    A mathematical model for the development of an epidemic on a plant cultivar mixture illustrates the influence of the infection efficiency, spore production rate, proportion of deposited spores, frequency of autodeposition, and composition of the mixture on the genetic composition of the pathogen...

  8. Mixture including hydrogen and hydrocarbon having pressure-temperature stability

    Science.gov (United States)

    Mao, Wendy L. (Inventor); Mao, Ho-Kwang (Inventor)

    2009-01-01

    The invention relates to a method of storing hydrogen that employs a mixture of hydrogen and a hydrocarbon that can both be used as fuel. In one embodiment, the method involves maintaining a mixture including hydrogen and a hydrocarbon in the solid state at ambient pressure and a temperature in excess of about 10 K.

  9. Kelvin Equation for a Non-Ideal Multicomponent Mixture

    DEFF Research Database (Denmark)

    Shapiro, Alexander; Stenby, Erling Halfdan

    1997-01-01

    The Kelvin equation is generalized by application to a case of a multicomponent non-ideal mixture. Such a generalization is necessary in order to describe the two-phase equilibrium in a capillary medium with respect to both normal and retrograde condensation. The equation obtained is applied...... to the equilibrium state of a hydrocarbon mixture ina gas-condensate reservoir....

  10. Directed Assembly of colloidal rods, spheres and their mixtures

    NARCIS (Netherlands)

    Bakker, H.E.

    2017-01-01

    The directed assembly of colloidal rods, spheres and their mixtures in external fields such as gravity, electric fields and shear flow was investigated. Using confocal microscopy we determined the experimental phase diagram of a binary mixture of colloidal silica rods and spheres that form a binary

  11. Evaluating Mixture Modeling for Clustering: Recommendations and Cautions

    Science.gov (United States)

    Steinley, Douglas; Brusco, Michael J.

    2011-01-01

    This article provides a large-scale investigation into several of the properties of mixture-model clustering techniques (also referred to as latent class cluster analysis, latent profile analysis, model-based clustering, probabilistic clustering, Bayesian classification, unsupervised learning, and finite mixture models; see Vermunt & Magdison,…

  12. Thermodynamic study of (anthracene + phenanthrene) solid state mixtures

    Science.gov (United States)

    Rice, James W.; Fu, Jinxia; Sandström, Emma; Ditto, Jenna C.; Suuberg, Eric M.

    2015-01-01

    Polycyclic aromatic hydrocarbons (PAH) are common components of many materials, such as petroleum and various types of tars. They are generally present in mixtures, occurring both naturally and as byproducts of fuel processing operations. It is important to understand the thermodynamic properties of such mixtures in order to understand better and predict their behavior (i.e., fate and transport) in the environment and in industrial operations. To characterize better the thermodynamic behavior of PAH mixtures, the phase behavior of a binary (anthracene + phenanthrene) system was studied by differential scanning calorimetry, X-ray diffraction, and the Knudsen effusion technique. Mixtures of (anthracene + phenanthrene) exhibit non-ideal mixture behavior. They form a lower-melting, phenanthrene-rich phase with an initial melting temperature of 372 K (identical to the melting temperature of pure phenanthrene) and a vapor pressure of roughly lnP/Pa = −2.38. The phenanthrene-rich phase coexists with an anthracene-rich phase when the mole fraction of phenanthrene (xP) in the mixture is less than or equal to 0.80. Mixtures initially at xP = 0.90 consist entirely of the phenanthrene-rich phase and sublime at nearly constant vapor pressure and composition, consistent with azeotrope-like behavior. Quasi-azeotropy was also observed for very high-content anthracene mixtures (2.5 < xP < 5) indicating that anthracene may accommodate very low levels of phenanthrene in its crystal structure. PMID:26973354

  13. Malabsorption of fructose-sorbitol mixtures. Interactions causing abdominal distress

    DEFF Research Database (Denmark)

    Rumessen, J J; Gudmand-Høyer, E

    1987-01-01

    Hydrogen breath tests were performed on 10 healthy adults after they had ingested a mixture of sorbitol and fructose, in which these substances were present in amounts corresponding to the individual absorption capacities. A significant malabsorption of this mixture was evident in 7 of 10 subjects...

  14. Thermodynamic study of (anthracene + phenanthrene) solid state mixtures.

    Science.gov (United States)

    Rice, James W; Fu, Jinxia; Sandström, Emma; Ditto, Jenna C; Suuberg, Eric M

    2015-11-01

    Polycyclic aromatic hydrocarbons (PAH) are common components of many materials, such as petroleum and various types of tars. They are generally present in mixtures, occurring both naturally and as byproducts of fuel processing operations. It is important to understand the thermodynamic properties of such mixtures in order to understand better and predict their behavior (i.e., fate and transport) in the environment and in industrial operations. To characterize better the thermodynamic behavior of PAH mixtures, the phase behavior of a binary (anthracene + phenanthrene) system was studied by differential scanning calorimetry, X-ray diffraction, and the Knudsen effusion technique. Mixtures of (anthracene + phenanthrene) exhibit non-ideal mixture behavior. They form a lower-melting, phenanthrene-rich phase with an initial melting temperature of 372 K (identical to the melting temperature of pure phenanthrene) and a vapor pressure of roughly lnP/Pa = -2.38. The phenanthrene-rich phase coexists with an anthracene-rich phase when the mole fraction of phenanthrene (xP) in the mixture is less than or equal to 0.80. Mixtures initially at xP = 0.90 consist entirely of the phenanthrene-rich phase and sublime at nearly constant vapor pressure and composition, consistent with azeotrope-like behavior. Quasi-azeotropy was also observed for very high-content anthracene mixtures (2.5 anthracene may accommodate very low levels of phenanthrene in its crystal structure.

  15. Explaining slow convergence of EM in low noise linear mixtures

    OpenAIRE

    Petersen, Kaare Brandt; Winther, Ole

    2005-01-01

    This report conducts an investigation of the convergence properties of the EM algorithm used for linear mixture models. Since the linear mixture model is a rather general approach, the analysis is relevant for a wide range of models which to some degree are subsets of each other: Independent Component Analysis (ICA), probabilistic PCA, Factor Analysis (FA), Independent Factor Analysis (IFA) and Mean Field ICA.

  16. Mixture Experiment Alternatives to the Slack Variable Approach

    Energy Technology Data Exchange (ETDEWEB)

    Piepel, Gregory F.; Landmesser, Samantha M.

    2009-07-01

    A mixture experiment involves mixing two or more components in various proportions and measuring one or more response variables on each mixture. This article presents mixture-experiment approaches for designing experiments and/or modeling the resulting data in situations where the slack-variable (SV) approach has been used. With the SV approach, one mixture component is designated the SV and the experiment is designed and/or the data are analyzed in terms of the remaining components. In a SV design, the proportion of the SV is obtained by subtracting from one the sum of the proportions of the remaining components, thus "taking up the slack". With the mixture-experiment approach, the experiment is designed and the data are analyzed using all of the mixture components. The article considers four situations in which the SV approach has been used, and explains for each situation that it is generally preferable to use an appropriate mixture-experiment approach. For each situation, the recommended mixture-experiment approach is discussed and compared to the SV approach using an example.

  17. DESIGNS FOR MIXTURE AND PROCESS VARIABLES APPLIED IN TABLET FORMULATIONS

    NARCIS (Netherlands)

    DUINEVELD, CAA; SMILDE, AK; DOORNBOS, DA

    1993-01-01

    Although there are several methods for the construction of a design for process variables and mixture variables, there are not very many methods which are suitable to combine mixture and process variables in one design. Some of the methods which are feasible will be shown. These methods will be comp

  18. Herbal mixtures in the traditional medicine of Eastern Cuba

    NARCIS (Netherlands)

    Hernández, J.; Volpato, G.

    2004-01-01

    Herbal mixtures in the traditional medicine of Eastern Cuba. Traditional herbal mixtures in Eastern Cuba are investigated through interviews with 130 knowledgeable people and traditional healers of the provinces of Santiago de Cuba and Guantanamo. One hundred seventy plant species and other products

  19. A Novel Approach for Evaluating Carbamate Mixtures for Dose Additivity

    Science.gov (United States)

    Two mathematical approaches were used to test the hypothesis ofdose-addition for a binary and a seven-chemical mixture ofN-methyl carbamates, toxicologically similar chemicals that inhibit cholinesterase (ChE). In the more novel approach, mixture data were not included in the ana...

  20. Mechanistic and Economical Characteristics of Asphalt Rubber Mixtures

    Directory of Open Access Journals (Sweden)

    Mena I. Souliman

    2016-01-01

    Full Text Available Load associated fatigue cracking is one of the major distress types occurring in flexible pavement systems. Flexural bending beam fatigue laboratory test has been used for several decades and is considered to be an integral part of the new superpave advanced characterization procedure. One of the most significant solutions to prolong the fatigue life for an asphaltic mixture is to utilize flexible materials as rubber. A laboratory testing program was performed on a conventional and Asphalt Rubber- (AR- gap-graded mixtures to investigate the impact of added rubber on the mechanical, mechanistic, and economical attributes of asphaltic mixtures. Strain controlled fatigue tests were conducted according to American Association of State Highway and Transportation Officials (AASHTO procedures. The results from the beam fatigue tests indicated that the AR-gap-graded mixtures would have much longer fatigue life compared with the reference (conventional mixtures. In addition, a mechanistic analysis using 3D-Move software coupled with a cost analysis study based on the fatigue performance on the two mixtures was performed. Overall, analysis showed that AR modified asphalt mixtures exhibited significantly lower cost of pavement per 1000 cycles of fatigue life per mile compared to conventional HMA mixture.

  1. Learning High-Dimensional Mixtures of Graphical Models

    CERN Document Server

    Anandkumar, A; Kakade, S M

    2012-01-01

    We consider the problem of learning mixtures of discrete graphical models in high dimensions and propose a novel method for estimating the mixture components with provable guarantees. The method proceeds mainly in three stages. In the first stage, it estimates the union of the Markov graphs of the mixture components (referred to as the union graph) via a series of rank tests. It then uses this estimated union graph to compute the mixture components via a spectral decomposition method. The spectral decomposition method was originally proposed for latent class models, and we adapt this method for learning the more general class of graphical model mixtures. In the end, the method produces tree approximations of the mixture components via the Chow-Liu algorithm. Our output is thus a tree-mixture model which serves as a good approximation to the underlying graphical model mixture. When the union graph has sparse node separators, we prove that our method has sample and computational complexities scaling as poly(p, ...

  2. Thermo Physical Properties for Binary Mixture of Dimethylsulfoxide and Isopropylbenzene at Various Temperatures

    Directory of Open Access Journals (Sweden)

    Maninder Kumar

    2013-01-01

    Full Text Available Density, refractive index, speed of sound, and viscosity have been measured of binary mixture dimethylsulfoxide (DMSO + isopropylbenzene (CUMENE over the whole composition range at 298.15, 303.15, 308.15, and 313.15 K and atmospheric pressure. From these experimental measurements the excess molar volume, deviations in viscosity, molar refractivity, speed of sound, and isentropic compressibility have been calculated. These deviations have been correlated by a polynomial Redlich-Kister equation to derive the coefficients and standard error. The viscosities have furthermore been correlated with two or three parameter models, that is, herric correlation and McAllister model, respectively.

  3. Fluctuation theory for transport properties in multicomponent mixtures: thermodiffusion and heat conductivity

    DEFF Research Database (Denmark)

    Shapiro, Alexander

    2004-01-01

    The theory of transport properties in multicomponent gas and liquid mixtures, which was previously developed for diffusion coefficients, is extended onto thermodiffusion coefficients and heat conductivities. The derivation of the expressions for transport properties is based on the general...... statistical theory of fluctuations around an equilibrium state. The Onsager matrix of phenomenological coefficients is expressed in terms of the penetration lengths, including the newly introduced penetration length for the energy transfer. As an example, this penetration length is found from the known value...... of the heat conductivity coefficient for ideal gas. (C) 2003 Elsevier B.V. All rights reserved....

  4. Viscoelastic Analysis of Asphalt Mixture Based on Creep Test

    Directory of Open Access Journals (Sweden)

    Lihua Zhao

    2013-01-01

    Full Text Available Two kinds of mineral fibers were added to AC-16C asphalt mixture. Trabecular bending creep experiments of asphalt mixtures were carried out at -10 and 20°C. The influence of mineral fibers on the low temperature viscoelasticity of asphalt mixtures were analyzed systemically. Furthermore, by using Origin, Burgers viscoelastic model was used to investigate the parameter regression for the creep test results at the different temperatures. The results show that the addition of mineral fibers can effectively improve the bending creep rate of asphalt mixtures, indicates the increase of crack resistance of asphalt mixtures. Good agreement between experimental data and Burgers model was found. The parameters of Burgers model at different temperatures can also provide data support for the viscoelastic design of asphalt pavements.

  5. Malabsorption of fructose-sorbitol mixtures. Interactions causing abdominal distress

    DEFF Research Database (Denmark)

    Rumessen, J J; Gudmand-Høyer, E

    1987-01-01

    Hydrogen breath tests were performed on 10 healthy adults after they had ingested a mixture of sorbitol and fructose, in which these substances were present in amounts corresponding to the individual absorption capacities. A significant malabsorption of this mixture was evident in 7 of 10 subjects....... The mixture caused mild to severe gastrointestinal distress in five subjects. When the carbohydrates were given separately, symptoms were absent. There was a significant correlation between the individual absorption capacities of fructose and of sorbitol. A mixture containing a similar amount of fructose......, but given as sucrose, and a similar amount of sorbitol was further given to four of the seven subjects showing malabsorption of the fructose-sorbitol mixture. Malabsorption now failed to appear, and symptoms were absent. These findings are of potential importance for the understanding of the physiologic...

  6. Overlapping Mixtures of Gaussian Processes for the Data Association Problem

    CERN Document Server

    Lázaro-Gredilla, Miguel; Lawrence, Neil

    2011-01-01

    In this work we introduce a mixture of GPs to address the data association problem, i.e. to label a group of observations according to the sources that generated them. Unlike several previously proposed GP mixtures, the novel mixture has the distinct characteristic of using no gating function to determine the association of samples and mixture components. Instead, all the GPs in the mixture are global and samples are clustered following "trajectories" across input space. We use a non-standard variational Bayesian algorithm to efficiently recover sample labels and learn the hyperparameters. We show how multi-object tracking problems can be disambiguated and also explore the characteristics of the model in traditional regression settings.

  7. Thermodiffusion in multicomponent hydrocarbon mixtures: Experimental investigations and computational analysis

    Science.gov (United States)

    VanVaerenbergh, Stefan; Srinivasan, Seshasai; Saghir, M. Ziad

    2009-09-01

    In an unprecedented experimental investigation, a ternary and a four component hydrocarbon mixture at high pressure have been studied in a nearly convection free environment to understand the thermodiffusion process. A binary mixture has also been investigated in this environment. Experimental investigations of the three mixtures have been conducted in space onboard the spacecraft FOTON-M3 thereby isolating the gravity-induced convection that otherwise interferes with thermodiffusion experiments on Earth. The experimental results have also been used to test a thermodiffusion model that has been calibrated based on the results of previous experimental investigations. It was found that with an increase in the number of components in the mixtures, the performance of the thermodiffusion model deteriorated. Computational analysis was also made to estimate the possible sources of errors. Simulations showed that the vibrations of the spacecraft could influence the estimates of thermodiffusion factors. It was also found that they are sensitive to slight variations in the temperature of the mixture.

  8. Fitting of Finite Mixture Distributions to Motor Insurance Claims

    Directory of Open Access Journals (Sweden)

    P. Sattayatham

    2012-01-01

    Full Text Available Problem statement: The modeling of claims is an important task of actuaries. Our problem is in modelling the actual motor insurance claim data set. In this study, we show that the actual motor insurance claim can be fitted by a finite mixture model. Approach: Firstly, we analyse the actual data set and then we choose the finite mixture Lognormal distributions as our model. The estimated parameters of the model are obtained from the EM algorithm. Then, we use the K-S and A-D test for showing how well the finite mixture Lognormal distributions fit the actual data set. We also mention the bootstrap technique in estimating the parameters. Results: From the tests, we found that the finite mixture lognormal distributions fit the actual data set with significant level 0.10. Conclusion: The finite mixture Lognormal distributions can be fitted to motor insurance claims and this fitting is better when the number of components (k are increase.

  9. The scent of mixtures: rules of odour processing in ants.

    Science.gov (United States)

    Perez, Margot; Giurfa, Martin; d'Ettorre, Patrizia

    2015-03-02

    Natural odours are complex blends of numerous components. Understanding how animals perceive odour mixtures is central to multiple disciplines. Here we focused on carpenter ants, which rely on odours in various behavioural contexts. We studied overshadowing, a phenomenon that occurs when animals having learnt a binary mixture respond less to one component than to the other, and less than when this component was learnt alone. Ants were trained individually with alcohols and aldehydes varying in carbon-chain length, either as single odours or binary mixtures. They were then tested with the mixture and the components. Overshadowing resulted from the interaction between chain length and functional group: alcohols overshadowed aldehydes, and longer chain lengths overshadowed shorter ones; yet, combinations of these factors could cancel each other and suppress overshadowing. Our results show how ants treat binary olfactory mixtures and set the basis for predictive analyses of odour perception in insects.

  10. Phase and viscosity behaviour of refrigerant-lubricant mixtures

    DEFF Research Database (Denmark)

    Cisneros, Sergio; Garcia, J.; Fernandez, J.

    2005-01-01

    The understanding of thermophysical properties and phase behaviour of refrigerant-lubricant oil mixtures is highly important for the optimal design of refrigeration and air-conditioning systems. Refrigerant lubricant mixtures, which are likely to have strong asymmetry, can show complex phase...... behaviour such as closed miscibility gaps, open miscibility gaps, liquid-liquid-vapour equilibrium, and even barotropic phenomena (density inversions). In fact, the type of phase behaviour that refrigerant-lubricant mixtures may show is linked to the transition between different types of phase diagrams......, mainly as a function of the molecular asymmetry. This also has a profound effect in the mixture transport properties. Thus, in this work the general aspects of phase and viscosity behaviour linked to the type of asymmetry found in refrigerant-lubricant mixtures are discussed in the context of phase...

  11. Superfluid and Insulating Phases of Fermion Mixtures in Optical Lattices

    Science.gov (United States)

    Iskin, M.; de Melo, C. A. R. Sá

    2007-08-01

    The ground state phase diagram of fermion mixtures in optical lattices is analyzed as a function of interaction strength, fermion filling factor, and tunneling parameters. In addition to standard superfluid, phase-separated or coexisting superfluid excess-fermion phases found in homogeneous or harmonically trapped systems, fermions in optical lattices have several insulating phases, including a molecular Bose-Mott insulator (BMI), a Fermi-Pauli (band) insulator (FPI), a phase-separated BMI-FPI mixture or a Bose-Fermi checkerboard (BFC). The molecular BMI phase is the fermion mixture counterpart of the atomic BMI found in atomic Bose systems, the BFC or BMI-FPI phases exist in Bose-Fermi mixtures, and lastly the FPI phase is particular to the Fermi nature of the constituent atoms of the mixture.

  12. Evaluation of vapor compression cycles using nonazeotropic refrigerant mixtures

    Science.gov (United States)

    Merriam, Richard L.

    A comprehensive investigation is carried out, on a systematic and consistent basis, to explore a range of advanced heat pump cycle concepts using nonazeotropic refrigerants for COP enhancement and capacity modulation along with the trade-offs associated with refrigerant mixture selection. The objectives of the study were to: identify candidate nonazeotropic mixtures and advanced heat pump cycle concepts with emphasis on their potential for single-speed capacity modulation with mixture composition control; assess the effect of conjunction with nonazeotropic mixture cycles; evaluate the cycles analytically and recommend the most promising cycles and mixtures for further development; and provide recommendations relating to the needs for additional refrigerant property data, experimental studies of basic heat transfer phenomena with mixed refrigerants, development of system components, and/or more detailed modeling of specific components.

  13. Quantitative measurement of mixtures by terahertz time-domain spectroscopy

    Indian Academy of Sciences (India)

    Guifeng Liu; Zengyan Zhang; Shihua Ma; Hongwei Zhao; Xiaojing Ma; Wenfeng Wang

    2009-07-01

    Terahertz time-domain spectroscopy (THz-TDS) was applied for quantitatively analysing a series of binary mixtures and a ternary mixture. Binary mixtures having different weight ratios of two components, -aminophenol and m-nitroaniline, were investigated by THz-TDS in the range of 0.3 to 1.5 THz, and it was found that the absorption coefficients of the components in each mixture were linearly proportional to their concentrations in the mixture. The results from analysis were in agreement with actual values with a relative error of less than 7%. The quantitative method will help in the detection of illegal drugs, poisons and dangerous materials that are wrapped or mixed with other materials.

  14. Central Composite Design (CCD) applied for statistical optimization of glucose and sucrose binary carbon mixture in enhancing the denitrification process

    Science.gov (United States)

    Lim, Jun-Wei; Beh, Hoe-Guan; Ching, Dennis Ling Chuan; Ho, Yeek-Chia; Baloo, Lavania; Bashir, Mohammed J. K.; Wee, Seng-Kew

    2016-12-01

    The present study provides an insight into the optimization of a glucose and sucrose mixture to enhance the denitrification process. Central Composite Design was applied to design the batch experiments with the factors of glucose and sucrose measured as carbon-to-nitrogen (C:N) ratio each and the response of percentage removal of nitrate-nitrogen (NO3 --N). Results showed that the polynomial regression model of NO3 --N removal had been successfully derived, capable of describing the interactive relationships of glucose and sucrose mixture that influenced the denitrification process. Furthermore, the presence of glucose was noticed to have more consequential effect on NO3 --N removal as opposed to sucrose. The optimum carbon sources mixture to achieve complete removal of NO3 --N required lesser glucose (C:N ratio of 1.0:1.0) than sucrose (C:N ratio of 2.4:1.0). At the optimum glucose and sucrose mixture, the activated sludge showed faster acclimation towards glucose used to perform the denitrification process. Later upon the acclimation with sucrose, the glucose uptake rate by the activated sludge abated. Therefore, it is vital to optimize the added carbon sources mixture to ensure the rapid and complete removal of NO3 --N via the denitrification process.

  15. Stability of porridge pre-mixture made with Brazil nut flour and green banana flour with and without milk powder

    Directory of Open Access Journals (Sweden)

    Clarissa Reschke Da Cunha

    2014-09-01

    Full Text Available The mixture of Brazil nut flour and green banana flour can improve the nutritional value of school meals, allowing for the use of regional ingredients derived from family agriculture. This study aimed to assess the stability of porridge pre-mixtures made with Brazil nut flour and green banana flour during six months of storage. Two types of pre-mixture were evaluated: with and without milk powder. These mixtures were packed in polyethylene/metallized polyester film, vacuum-sealed, and stored at room temperature. The products were evaluated for physicochemical composition, and every 30 days for moisture content, water activity, titratable acidity, pH, peroxide value and acidity of the lipid phase, total and thermotolerant coliforms, yeasts and molds, and sensory acceptance. There was no difference between the mixtures for the parameters evaluated. Moisture content, water activity, acidity of the lipid phase, and the yeast and mold count increased with storage time. The growth of yeasts and molds was more pronounced after 90 days of storage, when water activity reached the limit of 0.60. Although both products had good sensory acceptance throughout the period of study, it is recommended that the shelf life does not exceed 90 days.

  16. Determination of the combustion behavior for pure components and mixtures using a 20-liter sphere

    Science.gov (United States)

    Mashuga, Chad Victor

    1999-11-01

    The safest method to prevent fires and explosions of flammable vapors is to prevent the existence of flammable mixtures in the first place. This methodology requires detailed knowledge of the flammability region as a function of the fuel, oxygen, and nitrogen concentrations. A triangular flammability diagram is the most useful tool to display the flammability region, and to determine if a flammable mixture is present during plant operations. An automated apparatus for assessing the flammability region and for determining the potential effect of confined fuel-air explosions is described. Data derived from the apparatus included the limits of combustion, maximum combustion pressure, and the deflagration index, or KG. Accurate measurement of these parameters can be influenced by numerous experimental conditions, including igniter energy, humidity and gas composition. Gas humidity had a substantial effect on the deflagration index, but had little effect on the maximum combustion pressure. Small changes in gas compositions had a greater effect on the deflagration index than the maximum combustion pressure. Both the deflagration indices and the maximum combustion pressure proved insensitive to the range of igniter energies examined. Estimation of flammability limits using a calculated adiabatic flame temperature (CAFT) method is demonstrated. The CAFT model is compared with the extensive experimental data from this work for methane, ethylene and a 50/50 mixture of methane and ethylene. The CAFT model compares well to methane and ethylene throughout the flammability zone when using a 1200K threshold temperature. Deviations between the method and the experimental data occurs in the fuel rich region. For the 50/50 fuel mixture the CAFT deviates only in the fuel rich region---the inclusion of carbonaceous soot as one of the equilibrium products improved the fit. Determination of burning velocities from a spherical flame model utilizing the extensive pressure---time data was

  17. A NEW FRACTAL DERIVATION

    OpenAIRE

    Ji-Huan He

    2011-01-01

    A new fractal derive is defined, which is very easy for engineering applications to discontinuous problems, two simple examples are given to elucidate to establish governing equations with fractal derive and how to solve such equations, respectively.

  18. IGNITION IMPROVEMENT OF LEAN NATURAL GAS MIXTURES

    Energy Technology Data Exchange (ETDEWEB)

    Jason M. Keith

    2005-02-01

    This report describes work performed during a thirty month project which involves the production of dimethyl ether (DME) on-site for use as an ignition-improving additive in a compression-ignition natural gas engine. A single cylinder spark ignition engine was converted to compression ignition operation. The engine was then fully instrumented with a cylinder pressure transducer, crank shaft position sensor, airflow meter, natural gas mass flow sensor, and an exhaust temperature sensor. Finally, the engine was interfaced with a control system for pilot injection of DME. The engine testing is currently in progress. In addition, a one-pass process to form DME from natural gas was simulated with chemical processing software. Natural gas is reformed to synthesis gas (a mixture of hydrogen and carbon monoxide), converted into methanol, and finally to DME in three steps. Of additional benefit to the internal combustion engine, the offgas from the pilot process can be mixed with the main natural gas charge and is expected to improve engine performance. Furthermore, a one-pass pilot facility was constructed to produce 3.7 liters/hour (0.98 gallons/hour) DME from methanol in order to characterize the effluent DME solution and determine suitability for engine use. Successful production of DME led to an economic estimate of completing a full natural gas-to-DME pilot process. Additional experimental work in constructing a synthesis gas to methanol reactor is in progress. The overall recommendation from this work is that natural gas to DME is not a suitable pathway to improved natural gas engine performance. The major reasons are difficulties in handling DME for pilot injection and the large capital costs associated with DME production from natural gas.

  19. Mixtures of multiplicative cascade models in geochemistry

    Directory of Open Access Journals (Sweden)

    F. P. Agterberg

    2007-05-01

    Full Text Available Multifractal modeling of geochemical map data can help to explain the nature of frequency distributions of element concentration values for small rock samples and their spatial covariance structure. Useful frequency distribution models are the lognormal and Pareto distributions which plot as straight lines on logarithmic probability and log-log paper, respectively. The model of de Wijs is a simple multiplicative cascade resulting in discrete logbinomial distribution that closely approximates the lognormal. In this model, smaller blocks resulting from dividing larger blocks into parts have concentration values with constant ratios that are scale-independent. The approach can be modified by adopting random variables for these ratios. Other modifications include a single cascade model with ratio parameters that depend on magnitude of concentration value. The Turcotte model, which is another variant of the model of de Wijs, results in a Pareto distribution. Often a single straight line on logarithmic probability or log-log paper does not provide a good fit to observed data and two or more distributions should be fitted. For example, geochemical background and anomalies (extremely high values have separate frequency distributions for concentration values and for local singularity coefficients. Mixtures of distributions can be simulated by adding the results of separate cascade models. Regardless of properties of background, an unbiased estimate can be obtained of the parameter of the Pareto distribution characterizing anomalies in the upper tail of the element concentration frequency distribution or lower tail of the local singularity distribution. Computer simulation experiments and practical examples are used to illustrate the approach.

  20. Separating Dust Mixtures and Other External Aerosol Mixtures Using Airborne High Spectral Resolution Lidar Data

    Science.gov (United States)

    Burton, S. P.; Ferrare, R. A.; Vaughan, M.; Hostetler, C. A.; Rogers, R. R.; Hair, J. W.; Cook, A. L.; Harper, D. B.

    2013-12-01

    Knowledge of aerosol type is important for source attribution and for determining the magnitude and assessing the consequences of aerosol radiative forcing. The NASA Langley Research Center airborne High Spectral Resolution Lidar (HSRL-1) has acquired considerable datasets of both aerosol extensive parameters (e.g. aerosol optical depth) and intensive parameters (e.g. aerosol depolarization ratio, lidar ratio) that can be used to infer aerosol type. An aerosol classification methodology has been used extensively to classify HSRL-1 aerosol measurements of different aerosol types including dust, smoke, urban pollution, and marine aerosol. However, atmospheric aerosol is frequently not a single pure type, but instead occurs as a mixture of types, and this mixing affects the optical and radiative properties of the aerosol. Here we present a comprehensive and unified set of rules for characterizing external mixtures using several key aerosol intensive parameters: extinction-to-backscatter ratio (i.e. lidar ratio), backscatter color ratio, and depolarization ratio. Our mixing rules apply not just to the scalar values of aerosol intensive parameters, but to multi-dimensional normal distributions with variance in each measurement dimension. We illustrate the applicability of the mixing rules using examples of HSRL-1 data where mixing occurred between different aerosol types, including advected Saharan dust mixed with the marine boundary layer in the Caribbean Sea and locally generated dust mixed with urban pollution in the Mexico City surroundings. For each of these cases we infer a time-height cross section of mixing ratio along the flight track and we partition aerosol extinction into portions attributed to the two pure types. Since multiple aerosol intensive parameters are measured and included in these calculations, the techniques can also be used for cases without significant depolarization (unlike similar work by earlier researchers), and so a third example of a

  1. Sensitization of Xanthophylls-Chlorophyllin Mixtures on Titania Solar Cells

    Directory of Open Access Journals (Sweden)

    Indriana Kartini

    2015-03-01

    Full Text Available Co-sensitization of natural dyes on TiO2 for dye-sensitized solar cell (DSSC was proposed between chlorophyllin (C and xanthophylls (X at various volume ratios of C/X. Chlorophyllin is chlorophyll derivative providing -COOH groups essential for binding to TiO2. The chlorophyll was extracted from dried spinach (amaranthus viridis leaves in a mixture of methanol-acetone (70%:30%. Chlorophyll extract dye was obtained after partition of the crude extracts in diethyl ether solution. Then, it was hydrolyzed under alkaline condition to get chlorophyllin. Xanthophyll was extracted from fresh petal of chrysanthemum (chrysanthemum indicum flowers. Blending of chlorophyllin and xanthophyll was carried out at various volume ratios of C to X (1:0, 5:1, 1:1, 1:5, 0:1. Titania solar cells were constructed in sandwich system of conducting glass-titania/dyes as the photoanode and conducting glass-platinum as the photocathode. Electrolyte solution containing I-/I3- was inserted between the electrodes by capillary action. All dye extracts and blending solutions were analyzed by UV-Vis spectrophotometer. It is shown that the absorption spectra of blending dyes are complimentary in the visible region resulted in a panchromatic response of the dyes. From the cyclic voltammogram of the dyes and blended-dyes, it is found that the energy level of xanthophyll is the lowest. The I-V test at 100 mw/cm2 irradiation confirmed that the energy conversion efficiency (h of the blended dyes of xanthophyll and chlorophyllin-sensitized solar cell resulted in significant improvement than those of the single dye. Beneficially, the mixed dyes can be adsorbed from solution blend using single dipping step.

  2. Dynamic self-organization of microwell-aggregated cellular mixtures.

    Science.gov (United States)

    Song, Wei; Tung, Chih-Kuan; Lu, Yen-Chun; Pardo, Yehudah; Wu, Mingming; Das, Moumita; Kao, Der-I; Chen, Shuibing; Ma, Minglin

    2016-06-29

    Cells with different cohesive properties self-assemble in a spatiotemporal and context-dependent manner. Previous studies on cell self-organization mainly focused on the spontaneous structural development within a short period of time during which the cell numbers remained constant. However the effect of cell proliferation over time on the self-organization of cells is largely unexplored. Here, we studied the spatiotemporal dynamics of self-organization of a co-culture of MDA-MB-231 and MCF10A cells seeded in a well defined space (i.e. non-adherent microfabricated wells). When cell-growth was chemically inhibited, high cohesive MCF10A cells formed a core surrounded by low cohesive MDA-MB-231 cells on the periphery, consistent with the differential adhesion hypothesis (DAH). Interestingly, this aggregate morphology was completely inverted when the cells were free to grow. At an initial seeding ratio of 1 : 1 (MDA-MB-231 : MCF10A), the fast growing MCF10A cells segregated in the periphery while the slow growing MDA-MB-231 cells stayed in the core. Another morphology developed at an inequal seeding ratio (4 : 1), that is, the cell mixtures developed a side-by-side aggregate morphology. We conclude that the cell self-organization depends not only on the cell cohesive properties but also on the cell seeding ratio and proliferation. Furthermore, by taking advantage of the cell self-organization, we purified human embryonic stem cells-derived pancreatic progenitors (hESCs-PPs) from co-cultured feeder cells without using any additional tools or labels.

  3. Derived equivalence of algebras

    Institute of Scientific and Technical Information of China (English)

    杜先能

    1997-01-01

    The derived equivalence and stable equivalence of algebras RmA and RmB are studied It is proved, using the tilting complex, that RmA and RmB are derived-equivalent whenever algebras A and B are derived-equivalent

  4. Phase equilibria in ionic liquid-aromatic compound mixtures, including benzene fluorination effects.

    Science.gov (United States)

    Blesic, Marijana; Lopes, José N Canongia; Pádua, Agílio A H; Shimizu, Karina; Gomes, Margarida F Costa; Rebelo, Luís Paulo N

    2009-05-28

    This work extends the scope of previous studies on the phase behavior of mixtures of ionic liquids with benzenes or its derivatives by determining the solid-liquid and liquid-liquid phase diagrams of mixtures containing an ionic liquid and a fluorinated benzene. The systems studied include 1-ethyl-3-methylimidazolium bis(trifluoromethanesulfonyl)imide plus hexafluorobenzene or 1,3,5-trifluorobenzene and 1-ethyl-3-methylimidazolium triflate or N-ethyl-N-methylpyrrolidinium bis(trifluoromethanesulfonyl)imide plus benzene. The phase diagrams exhibit different kinds of solid-liquid behavior: the (usual) occurrence of eutectic points; the (not-so-usual) presence of congruent melting points and the corresponding formation of inclusion crystals; or the observation of different ionic liquid crystalline phases (polymorphism). These different types of behavior can be controlled by temperature annealing during crystallization or by the nature of the aromatic compound and can be interpreted, at a molecular level, taking into account the structure of the crystals or liquid mixtures, together with the unique characteristics of ionic liquids, namely the dual nature of their interactions with aromatic compounds.

  5. Flame propagation and counterflow nonpremixed ignition of mixtures of methane and ethylene

    Energy Technology Data Exchange (ETDEWEB)

    Liu, W.; Kelley, A.P.; Law, C.K. [Department of Mechanical and Aerospace Engineering, Princeton University, Princeton, NJ 08544 (United States)

    2010-05-15

    The ignition temperature of nitrogen-diluted mixtures of methane and ethylene counterflowing against heated air was measured up to five atmospheres. In addition, the stretch-corrected laminar flame speeds of mixtures of air, methane and ethylene were determined from outwardly-propagating spherical flames up to 10 atmospheres, for extensive range of the lean-to-rich equivalence ratio. These experimental data, relevant to low- to moderately-high-temperature ignition chemistry and high-temperature flame chemistry, respectively, were subsequently compared with calculations using two detailed kinetic mechanisms. A chemical explosive mode analysis (CEMA) was then conducted to identify the dominant ignition chemistry and the role of ethylene addition in facilitating nonpremixed ignition. Furthermore, the hierarchical structure of the associated oxidation kinetics was examined by comparing the sizes and constituents of the skeletal mechanisms of the pure fuels and their mixtures, derived using the method of directed relation graph (DRG). The skeletal mechanism was further reduced by time-scale analysis, leading to a 24-species reduced mechanism from the detailed mechanism of USC Mech II, validated within the parameter space of the conducted experiments. (author)

  6. Pharmacological characteristics of Kampo medicine as a mixture of constituents and ingredients

    Institute of Scientific and Technical Information of China (English)

    Hiroyasu Satoh

    2013-01-01

    Herbal medicine in Japan is termed as Kampo medicine,which is derived from traditional Chinese medicine.Shakuyakukanzoto (Shao-Yao-Gan-Cao-Tang) as a kind of Kampo formulations is composed of just two components; Paeoniae Radix and Glycyrrhizae Radix,which produced marked relaxation of intestinal tract.Mokuboito (Mu-Fang-Ji-Tang) inhibited cardiac ionic channel currents,and as a mixture also produced great vasodilatation.Sinomenine (a main ingredient of Mokuboito) as a single compound also caused the vasodilatation,but decreased it along with ageing.Gypsum containing in Mokuboito and Chotosan (Diao-Teng-San)caused more marked effects,as compared with those without Gypsum.On the other hand,Rokumigan (Liu-Wei-Wan),Hachimijiogan (Ba-Wei-Di-Huang-Wan) and Goshajinkigan (Niu-Che-Shen-Qi-Wan) increase in order the number of contained ingredients.The formulations with more herbs (ingredients) produced much more effective actions on rat aorta,presumably due to compensation of the decline of pharmacological sensitivity with ageing.Thus,there are some important differences between single chemical drugs and mixture drugs with many ingredients.The effects of Kampo medicine (mixture) are never just a sum of each effect induced by a lot of ingredients.For elder persons,furthermore,Kampo medicine exerts more effective actions.

  7. Growing Tomato Plantlets on Various Mixtures of Peat and Sand or Peat and Perlite. Note 1

    Directory of Open Access Journals (Sweden)

    Antonia Patruno

    Full Text Available Given the considerable interest in use of substrates derived from various mixtures in the nursery sector and in light of the enormous variety of possibilities offered by this technique, in contrast with the still small number of researches dedicated to this theme, this study was set out to examine in-depth the growing of tomato plantlets on peat-based substrates. Two series of peat mixtures were produced, one with sand and the other with perlite, with a volume ratio of the other two components with respect to the peat of 1:0, 2.5:1, 1:1 and 1:2.5. Tomato seedlings were cultivated for 30 or 25 days in small perforated pots containing these mixtures. The irrigation was calculated by weighing each pot daily, measuring the water lost by evaporation-transpiration, then just past an established lower threshold value bringing the water back up to a defined upper threshold. Two water regimes were compared in the sand series and three in the perlite series.

  8. Efficient and robust relaxation procedures for multi-component mixtures including phase transition

    Energy Technology Data Exchange (ETDEWEB)

    Han, Ee, E-mail: eehan@math.uni-bremen.de [Zentrum für Technomathematik, Universität Bremen, Bibliothekstraße 1, D-28359 Bremen (Germany); Hantke, Maren, E-mail: maren.hantke@ovgu.de [Institut für Analysis und Numerik, Otto-von-Guericke-Universität Magdeburg, PSF 4120, D-39016 Magdeburg (Germany); Müller, Siegfried, E-mail: mueller@igpm.rwth-aachen.de [Institut für Geometrie und Praktische Mathematik, RWTH Aachen University, Templergraben 55, D-52056 Aachen (Germany)

    2017-06-01

    We consider a thermodynamic consistent multi-component model in multi-dimensions that is a generalization of the classical two-phase flow model of Baer and Nunziato. The exchange of mass, momentum and energy between the phases is described by additional source terms. Typically these terms are handled by relaxation procedures. Available relaxation procedures suffer from efficiency and robustness resulting in very costly computations that in general only allow for one-dimensional computations. Therefore we focus on the development of new efficient and robust numerical methods for relaxation processes. We derive exact procedures to determine mechanical and thermal equilibrium states. Further we introduce a novel iterative method to treat the mass transfer for a three component mixture. All new procedures can be extended to an arbitrary number of inert ideal gases. We prove existence, uniqueness and physical admissibility of the resulting states and convergence of our new procedures. Efficiency and robustness of the procedures are verified by means of numerical computations in one and two space dimensions. - Highlights: • We develop novel relaxation procedures for a generalized, thermodynamically consistent Baer–Nunziato type model. • Exact procedures for mechanical and thermal relaxation procedures avoid artificial parameters. • Existence, uniqueness and physical admissibility of the equilibrium states are proven for special mixtures. • A novel iterative method for mass transfer is introduced for a three component mixture providing a unique and admissible equilibrium state.

  9. Characteristics of interaction between petrographically differing coals in mixtures for coking

    Energy Technology Data Exchange (ETDEWEB)

    Stankevich, A.S.; Proskuryakov, A.E.; Zolotukhin, Yu.A.

    1983-09-01

    Coal mixtures used for coking in the East of the USSR are characterized by intensive fluctuations of coak rank and petrology. Reflectivity coefficient of vitrinite ranges from 0.73 to 1.70% and content of caking components ranges from 30 to 88%. Evaluations show that fluctuations of reflectivity coefficient of vitrinite and fluctuations of caking component content in coal negatively influence coke mechanical properties and increase coke reactivity. Effects of coal macerals and microlithotypes in black coal from the Kuzbass on coke properties are analyzed. The following microlithotypes are separated from coal: vitrite, clarite, duroclarite, clarodurite, durite, fusite, semivitrinite, mineralized coal and rocks. Effects of macerals and microlithotypes in 50 coal mixtures on coke quality and coke properties are analyzed. Regression analysis is used. On the basis of this analysis equations for forecasting coke properties are derived. Petrologic nonhomogeneity of coal mixtures deteriorates conditions for chemical interaction between components with differing genetics and negatively influences caking of vitrite and fusite (or durite). Coke from coal characterized by petrologic nonhomogeneity has a structure with low degree of order, low mechanical and structural strength and increased reactivity. (5 refs.) (In Russian)

  10. Fick diffusion coefficients of liquid mixtures directly obtained from equilibrium molecular dynamics.

    Science.gov (United States)

    Liu, Xin; Schnell, Sondre K; Simon, Jean-Marc; Bedeaux, Dick; Kjelstrup, Signe; Bardow, André; Vlugt, Thijs J H

    2011-11-10

    A methodology for computing Fick diffusivities directly from equilibrium molecular dynamics (MD) simulations is presented and validated for acetone-methanol and acetone-tetrachloromethane liquid mixtures. Fick diffusivities are obtained from Maxwell-Stefan (MS) diffusivities and the so-called thermodynamic factor. MS diffusivities describe the friction between different components, while the thermodynamic factor is the concentration derivative of the activity describing the deviation from ideal mixing behavior. It is important to note that all mutual diffusion experiments measure Fick diffusion coefficients, while molecular simulation provides MS diffusivities. The required thermodynamic factor to convert MS into Fick diffusivities and vice versa, however, is usually difficult to extract from both simulations and experiments leaving a gap between theory and application. Here, we employ our novel method to compute the thermodynamic factor from small-scale density fluctuations in equilibrium MD simulations [Chem. Phys. Lett.2011, 504, 199-201]. Previously, this method was developed and validated for molecules with single interaction sites only. In this work, we applied this method to acetone-methanol and acetone-tetrachloromethane liquid mixtures and show that the method also works well in these more complex systems. This provides the missing step to extract Fick diffusion coefficients directly from equilibrium MD simulations. The computed Fick diffusivities of acetone-methanol and acetone-tetrachloromethane mixtures are in excellent agreement with experimental values. The suggested framework thus provides an efficient route to model diffusion in liquids on the basis of a consistent molecular picture.

  11. IMPROVED INFORMATIVE PRIOR FOR THE MIXTURE OF LAPLACE DISTRIBUTION UNDER DIFFERENT LOSS FUNCTIONS

    Directory of Open Access Journals (Sweden)

    Sajid Ali

    2011-01-01

    Full Text Available In this study, a new informative prior is developed for the scale parameter of themixture of Laplace distribution when data is censored and can be used to model various realworld problems. The basic proposal is to merge both informative and non-informative priors forimprovement of prior information. There are many real world problems in which investigator hasdifferent opinion than prior information e.g. one doctor provides information that the harmfulnessof medicine is 20% and another chemist observes the chemical combination of medicine andthinks that medicine is harmful 30% due to one element, so if we combine both doctor andchemist opinion as a prior our analysis will improve. An inclusive simulation scheme including alarge number of parameter is followed to highlight properties and behavior of the estimates interms of sample size, censoring rate and proportion of the component of the mixture. A simulatedmixture data with censored observations is generated by probabilistic mixing for computationalpurposes. Elegant closed form expressions for the Bayes estimators and their posterior risk arederived for the censored sample as well as for the complete sample. Some interesting comparisonand properties of the estimates are observed and presented. The complete sample expressions forML estimates and for their variances are derived and also the components of the informationmatrix are constructed as well. The Elicitation of hyper-parameters of mixture through priorpredictive approach and a real-life mixture data example has also been discussed. The Bayesestimates are evaluated under squared error loss function and precautionary loss function.

  12. A Novel Calibration-Minimum Method for Prediction of Mole Fraction in Non-Ideal Mixture.

    Science.gov (United States)

    Shibayama, Shojiro; Kaneko, Hiromasa; Funatsu, Kimito

    2016-05-11

    This article proposes a novel concentration prediction model that requires little training data and is useful for rapid process understanding. Process analytical technology is currently popular, especially in the pharmaceutical industry, for enhancement of process understanding and process control. A calibration-free method, iterative optimization technology (IOT), was proposed to predict pure component concentrations, because calibration methods such as partial least squares, require a large number of training samples, leading to high costs. However, IOT cannot be applied to concentration prediction in non-ideal mixtures because its basic equation is derived from the Beer-Lambert law, which cannot be applied to non-ideal mixtures. We proposed a novel method that realizes prediction of pure component concentrations in mixtures from a small number of training samples, assuming that spectral changes arising from molecular interactions can be expressed as a function of concentration. The proposed method is named IOT with virtual molecular interaction spectra (IOT-VIS) because the method takes spectral change as a virtual spectrum x nonlin,i into account. It was confirmed through the two case studies that the predictive accuracy of IOT-VIS was the highest among existing IOT methods.

  13. Multivariate spatial Gaussian mixture modeling for statistical clustering of hemodynamic parameters in functional MRI

    Energy Technology Data Exchange (ETDEWEB)

    Fouque, A.L.; Ciuciu, Ph.; Risser, L. [NeuroSpin/CEA, F-91191 Gif-sur-Yvette (France); Fouque, A.L.; Ciuciu, Ph.; Risser, L. [IFR 49, Institut d' Imagerie Neurofonctionnelle, Paris (France)

    2009-07-01

    In this paper, a novel statistical parcellation of intra-subject functional MRI (fMRI) data is proposed. The key idea is to identify functionally homogenous regions of interest from their hemodynamic parameters. To this end, a non-parametric voxel-based estimation of hemodynamic response function is performed as a prerequisite. Then, the extracted hemodynamic features are entered as the input data of a Multivariate Spatial Gaussian Mixture Model (MSGMM) to be fitted. The goal of the spatial aspect is to favor the recovery of connected components in the mixture. Our statistical clustering approach is original in the sense that it extends existing works done on univariate spatially regularized Gaussian mixtures. A specific Gibbs sampler is derived to account for different covariance structures in the feature space. On realistic artificial fMRI datasets, it is shown that our algorithm is helpful for identifying a parsimonious functional parcellation required in the context of joint detection estimation of brain activity. This allows us to overcome the classical assumption of spatial stationarity of the BOLD signal model. (authors)

  14. Modelling shallow debris flows of the Coulomb-mixture type over temporally varying topography

    Directory of Open Access Journals (Sweden)

    Y. C. Tai

    2012-02-01

    Full Text Available We propose a saturated binary mixture model for debris flows of the Coulomb-mixture type over temporally varying topography, where the effects of erosion and deposition are considered. Due to the deposition or erosion processes, the interface between the moving material and the stagnant base is a non-material singular surface. The motion of this singular surface is determined by the mass exchange between the flowing layer and the ground. The ratio of the relative velocity between the two constituents to the velocity of the solid phase is assumed to be small, so that the governing equations can be reduced to a system of the quasi-single-phase type. A shock-capturing numerical scheme is implemented to solve the derived equation system. The deposition shapes of a finite mass sliding down an inclined planary chute are investigated for a range of mixture ratios. The geometric evolution of the deposition is presented, which allows the possibility of mimicking the development of levee deposition.

  15. Oxysterol mixture and, in particular, 27-hydroxycholesterol drive M2 polarization of human macrophages.

    Science.gov (United States)

    Marengo, Barbara; Bellora, Francesca; Ricciarelli, Roberta; De Ciucis, Chiara; Furfaro, AnnaLisa; Leardi, Riccardo; Colla, Renata; Pacini, Davide; Traverso, Nicola; Moretta, Alessandro; Pronzato, Maria Adelaide; Bottino, Cristina; Domenicotti, Cinzia

    2016-01-01

    Macrophages play a crucial role in atherosclerosis progression. Classically activated M1 macrophages have been found in rupture-prone atherosclerotic plaques whereas alternatively activated macrophages, M2, localize in stable plaque. Macrophage accumulation of cholesterol and of its oxidized derivatives (oxysterols) leads to the formation of foam cells, a hallmark of atherosclerotic lesions. In this study, the effects of oxysterols in determining the functional polarization of human macrophages were investigated. Monocytes, purified from peripheral blood mononuclear cells of healthy donors, were differentiated into macrophages (M0) and treated with an oxysterol mixture, cholesterol, or ethanol, every 4 H for a total of 4, 8, and 12 H. The administration of the compounds was repeated in order to maintain the levels of oxysterols constant throughout the treatment. Compared with ethanol treatment, the oxysterol mixture decreased the surface expression of CD36 and CD204 scavenger receptors and reduced the amount of reactive oxygen species whereas it did not affect either cell viability or matrix metalloprotease-9 activity. Moreover, the oxysterol mixture increased the expression of both liver X receptor α and ATP-binding cassette transporter 1. An enhanced secretion of the immunoregulatory cytokine IL-10 accompanied these events. The results supported the hypothesis that the constant levels of oxysterols and, in particular, of 27-hydroxycholesterol stimulate macrophage polarization toward the M2 immunomodulatory functional phenotype, contributing to the stabilization of atherosclerotic plaques.

  16. Comparative study on the selectivity of various spectrophotometric techniques for the determination of binary mixture of fenbendazole and rafoxanide.

    Science.gov (United States)

    Saad, Ahmed S; Attia, Ali K; Alaraki, Manal S; Elzanfaly, Eman S

    2015-11-05

    Five different spectrophotometric methods were applied for simultaneous determination of fenbendazole and rafoxanide in their binary mixture; namely first derivative, derivative ratio, ratio difference, dual wavelength and H-point standard addition spectrophotometric methods. Different factors affecting each of the applied spectrophotometric methods were studied and the selectivity of the applied methods was compared. The applied methods were validated as per the ICH guidelines and good accuracy; specificity and precision were proven within the concentration range of 5-50 μg/mL for both drugs. Statistical analysis using one-way ANOVA proved no significant differences among the proposed methods for the determination of the two drugs. The proposed methods successfully determined both drugs in laboratory prepared and commercially available binary mixtures, and were found applicable for the routine analysis in quality control laboratories.

  17. Authentication of Nigella sativa seed oil in binary and ternary mixtures with corn oil and soybean oil using FTIR spectroscopy coupled with partial least square.

    Science.gov (United States)

    Rohman, Abdul; Ariani, Rizka

    2013-01-01

    Fourier transform infrared spectroscopy (FTIR) combined with multivariate calibration of partial least square (PLS) was developed and optimized for the analysis of Nigella seed oil (NSO) in binary and ternary mixtures with corn oil (CO) and soybean oil (SO). Based on PLS modeling performed, quantitative analysis of NSO in binary mixtures with CO carried out using the second derivative FTIR spectra at combined frequencies of 2977-3028, 1666-1739, and 740-1446 cm(-1) revealed the highest value of coefficient of determination (R (2), 0.9984) and the lowest value of root mean square error of calibration (RMSEC, 1.34% v/v). NSO in binary mixtures with SO is successfully determined at the combined frequencies of 2985-3024 and 752-1755 cm(-1) using the first derivative FTIR spectra with R (2) and RMSEC values of 0.9970 and 0.47% v/v, respectively. Meanwhile, the second derivative FTIR spectra at the combined frequencies of 2977-3028 cm(-1), 1666-1739 cm(-1), and 740-1446 cm(-1) were selected for quantitative analysis of NSO in ternary mixture with CO and SO with R (2) and RMSEC values of 0.9993 and 0.86% v/v, respectively. The results showed that FTIR spectrophotometry is an accurate technique for the quantitative analysis of NSO in binary and ternary mixtures with CO and SO.

  18. Authentication of Nigella sativa Seed Oil in Binary and Ternary Mixtures with Corn Oil and Soybean Oil Using FTIR Spectroscopy Coupled with Partial Least Square

    Directory of Open Access Journals (Sweden)

    Abdul Rohman

    2013-01-01

    Full Text Available Fourier transform infrared spectroscopy (FTIR combined with multivariate calibration of partial least square (PLS was developed and optimized for the analysis of Nigella seed oil (NSO in binary and ternary mixtures with corn oil (CO and soybean oil (SO. Based on PLS modeling performed, quantitative analysis of NSO in binary mixtures with CO carried out using the second derivative FTIR spectra at combined frequencies of 2977–3028, 1666–1739, and 740–1446 cm−1 revealed the highest value of coefficient of determination (, 0.9984 and the lowest value of root mean square error of calibration (RMSEC, 1.34% v/v. NSO in binary mixtures with SO is successfully determined at the combined frequencies of 2985–3024 and 752–1755 cm−1 using the first derivative FTIR spectra with and RMSEC values of 0.9970 and 0.47% v/v, respectively. Meanwhile, the second derivative FTIR spectra at the combined frequencies of 2977–3028 cm−1, 1666–1739 cm−1, and 740–1446 cm−1 were selected for quantitative analysis of NSO in ternary mixture with CO and SO with and RMSEC values of 0.9993 and 0.86% v/v, respectively. The results showed that FTIR spectrophotometry is an accurate technique for the quantitative analysis of NSO in binary and ternary mixtures with CO and SO.

  19. Estimating mineral abundances of clay and gypsum mixtures using radiative transfer models applied to visible-near infrared reflectance spectra

    Science.gov (United States)

    Robertson, K. M.; Milliken, R. E.; Li, S.

    2016-10-01

    Quantitative mineral abundances of lab derived clay-gypsum mixtures were estimated using a revised Hapke VIS-NIR and Shkuratov radiative transfer model. Montmorillonite-gypsum mixtures were used to test the effectiveness of the model in distinguishing between subtle differences in minor absorption features that are diagnostic of mineralogy in the presence of strong H2O absorptions that are not always diagnostic of distinct phases or mineral abundance. The optical constants (k-values) for both endmembers were determined from bi-directional reflectance spectra measured in RELAB as well as on an ASD FieldSpec3 in a controlled laboratory setting. Multiple size fractions were measured in order to derive a single k-value from optimization of the optical path length in the radiative transfer models. It is shown that with careful experimental conditions, optical constants can be accurately determined from powdered samples using a field spectrometer, consistent with previous studies. Variability in the montmorillonite hydration level increased the uncertainties in the derived k-values, but estimated modal abundances for the mixtures were still within 5% of the measured values. Results suggest that the Hapke model works well in distinguishing between hydrated phases that have overlapping H2O absorptions and it is able to detect gypsum and montmorillonite in these simple mixtures where they are present at levels of ∼10%. Care must be taken however to derive k-values from a sample with appropriate H2O content relative to the modeled spectra. These initial results are promising for the potential quantitative analysis of orbital remote sensing data of hydrated minerals, including more complex clay and sulfate assemblages such as mudstones examined by the Curiosity rover in Gale crater.

  20. On a model of mixtures with internal variables: Extended Liu procedure for the exploitation of the entropy principle

    Directory of Open Access Journals (Sweden)

    Francesco Oliveri

    2016-01-01

    Full Text Available The exploitation of second law of thermodynamics for a mixture of two fluids with a scalar internal variable and a first order nonlocal state space is achieved by using the extended Liu approach. This method requires to insert as constraints in the entropy inequality either the field equations or their gradient extensions. Consequently, the thermodynamic restrictions imposed by the entropy principle are derived without introducing extra terms neither in the energy balance equation nor in the entropy inequality.