Search results for "Numeral system"
showing 10 items of 124 documents
First-principles study of the amorphous In3SbTe2phase change compound
2013
Ab initio molecular dynamics simulations based on density functional theory were performed to generate amorphous models of the phase change compound In${}_{3}$SbTe${}_{2}$ by quenching from the melt. In-Sb and In-Te are the most abundant bonds with only a minor fraction of Sb-Te bonds. The bonding geometry in the amorphous phase is, however, strongly dependent on the density in the range 6.448--5.75 g/cm${}^{3}$ that we investigated. While at high density the bonding geometry of In atoms is mostly octahedral-like as in the cubic crystalline phase of the ternary compound In${}_{3}$SbTe${}_{2}$, at low density we observed a sizable fraction of tetrahedral-like geometries similar to those pres…
1,3,5-triisopropylbenzene diffusion in polystyrene solutions
1996
Self-diffusion coefficients of 1,3,5-triisopropylbenzene (TIB) in binary solutions with polystyrene and ternary mixtures comprised of TIB, toluene, and polystyrene have been measured by static gradient nuclear magnetic resonance (SG-NMR) techniques. These data, as well as mutual-diffusion coefficient data measured by capillary column inverse gas chromatography (CCIGC), have been analyzed here with the Vrentas-Duda free-volume diffusion model. Although both binary and ternary diffusion coefficient data can be accurately correlated with the model, the results contradict those of an earlier investigation, which suggested that TIB diffuses as a single unit in polystyrene solutions. The new data…
Untersuchung des Solvatationsgleichgewichts im ternären system Tetrachlormethan/Polymethylmethacrylat/Benzol durch kernmagnetische relaxation
1971
Im ternaren System CCl4/Polymethacrylate(PMMA)/Benzol tritt praferentielle Solvatation auf, Benzol ist in der Solvathulle des Polymeren angereichert. Es genugt eine Solvatationsgleichgewichtskonstante, um die praferentielle Solvatation bei variablen Konzentrationsverhaltnissen zu beschreiben. Gemessen wurde die Kernmagnetische Relaxationszeit T1 von Benzol in Abhangigkeit von der Polymerkonzentration. Der Vergleich mit analogen Messungen im System C6D6/PMMA/C6H6 ergibt fur die Solvatationsgleichgewichtskonstante K = (c32 · c10)/(c12 · c30) = 2,5 ± 0,5. Hierbei bedeuten: c10 die CCl4-Konzentrationen im „freien” Losungsmittel, c30 die Benzolkonzentrationen im „freien” Losungsmittel, c12 und c…
NMR relaxation and solvation equilibrium in the ternary system CCl4-polymethylmethacrylate-benzene
2007
In the ternary system CCl4-PMMA-benzene, benzene is preferentially adsorbed in the solvation shell of the polymer. One solvation equilibrium constant allows a satisfactory description of the preferential solvation for a large range of solvent compositions. The nuclear magnetic relaxation time T1 of benzene protons was measured for different values of the polymer concentration. The measurements are compared with analogous measurements in the system C6D6-PMMA-C6H6 where no preferential solvation is to be expected. For the system CCl4-PMMA-benzene the resulting dimensionless solvation equilibrium constant is K = c32c10/c12c30 = 2.5 ± 0.5 where c10 is the CCl4 concentration in the “free” solven…
Case assignment, case concord, and quantificational case constructions
2011
Abstract This paper examines a controversial and particularly complex case phenomenon called quantificational case attested in a number of historically unrelated Slavonic and Finno-Ugric languages, and attempts to establish certain novel cross-linguistic generalizations and conclusions. In particular, it will be argued that (i) instead of standard one-to-one case assignment, in which one case assigner is case-related to one case assignee, a many-to-many case flow is attested; (ii) nominal case is not a privilege of full DPs, arguments or thematic roles; (iii) case reflects either local or nonlocal functional structure, whether in the verbal or nominal domain; and that (iv) there is no disti…
Prediction of pressure-induced superconductivity in the novel ternary system ScCaH2n (n = 1–6)
2021
Hydrogen-rich systems are currently thought to constitute the most promising potential high-temperature superconductor materials. Here, the high-pressure structure and superconductivity of the ternary hydrogen-rich system ScCaH2n (n = 1–6) are systematically investigated by using the prediction method of particle swarm optimization structure combined with first-principles calculations. As n increases, the electron local function (ELF) indicates that the hydrogen atoms in this system exhibit different behaviors corresponding to single H atoms, H2 molecules, graphene-like layers and, ultimately, H clathrate cages. The electron phonon coupling (EPC) calculation shows that the superconducting t…
Densities, Refractive Indices, and Excess Molar Volumes of Binary and Ternary Systems Containing Isobutyl Alcohol, Ethanol, 2-Methylpentane, and Meth…
2000
This paper reports experimental densities and refractive indices of binary and ternary systems containing isobutyl alcohol, ethanol, 2-methylpentane, and methyl tert-butyl ether over the whole composition range of mixtures at 298.15 K and atmospheric pressure. From these data, excess molar volumes VE have been calculated. These results are fitted to the Redlich−Kister and Cibulka polynomial equations to derive the binary and ternary coefficients, respectively.
Isobaric vapor-liquid equilibria for the extractive distillation of 2-propanol + water mixtures using 1-ethyl-3-methylimidazolium dicyanamide ionic l…
2017
Abstract Isobaric vapor–liquid equilibria for the binary systems 2-propanol + water, 2-propanol + 1-ethyl-3-methylimidazolium dicyanamide ([emim][DCA]), and water + [emim][DCA] as well as the vapor–liquid equilibria for the 2-propanol + water + [emim][DCA] ternary system have been obtained at 100 kPa using a recirculating still. The electrolyte nonrandom two-liquid (e-NRTL) model was used for fitting successfully the experimental data. The effect of [emim][DCA] on the 2-propanol + water system has been compared with that produced by other ionic liquids reported in the literature. From the results, [emim][DCA] appears as a good entrainer for the extractive distillation of this solvent mixtur…
Isobaric vapor-liquid equilibria for the 1-propanol + water + 1-ethyl-3-methylimidazolium dicyanamide system at 100 kPa
2017
Abstract Isobaric vapor–liquid equilibria for the 1-propanol + 1-ethyl-3-methylimidazolium dicyanamide ([emim [DCA] binary system and for the 1-propanol + water + [emim] [DCA] ternary system have been obtained at 100 kPa using a recirculating still. The electrolyte nonrandom two-liquid (e-NRTL) model was used for fitting successfully the experimental data. The effect of [emim][DCA] on the 1-propanol + water system has been compared with that produced by other ionic liquids reported in the literature. From the results, [emim][DCA] appears as a potential entrainer for the extractive distillation of this solvent mixture, causing the azeotrope to disappear at 100 kPa when the ionic liquid mole …
Energetics of Water−Dodecyl Surfactant−Macrocyclic Compound Ternary Systems
1996
Enthalpies of dilution and osmotic coefficients of sodium dodecyl sulfate (NaDS) and dodecyltrimethylammonium bromide (DTAB) in water + 18-crown-6 ether (CR) and water + β-cyclodextrin (CD) at a fixed cosolvent concentration were measured at 298 and 310 K, respectively, as functions of the surfactant concentration (mS). Enthalpies of transfer ΔH (W → W + S) of CR (0.03 m) from water to NaDS and DTAB aqueous solutions as functions of mS were also determined at 298 K. From the enthalpies of dilution the apparent (LΦ,S) and partial (L2,S) molar relative enthalpies of both surfactants were calculated. Despite CR forms inclusion complexes with the anionic surfactant only, the L2,S vs mS profiles…