Study of basic patterns of light scattering in aqueous solution of milling yellow

Basic characteristics of light scattering in an aqueous solution of milling yellow are presented in a form of relations between the scattered radiant power, states of polarization of primary radiation and scattered radiation, observation angle and azimuthal angle.It is found that the state of polarization of the scattered light in milling-yellow solution can be utilized as a foundation of reliable photoelastic scattered-light techniques for flow analysis. However, Rayleight's model of scattering is nnt directly applicable.Paper contains data on major parameters of light scattering, knowledge of which is necessary to correctly design flowbirefringence experiments. In particular, these data can be used to develop a set of conditions and constraints for designing of particular scattered-light flow-birefringence experiments, and of corresponding transfer functions.     

Significance of plaque morphology in modifying flow characteristics in a diseased coronary artery: Numerical simulation using plaque measurements from intravascular ultrasound imaging

The paper deals with numerical investigation of the effect of plaque morphology on the flow characteristics in a diseased coronary artery using realistic plaque morphology. The morphological information of the lumen and the plaque is obtained from intravascular ultrasound imaging measurements of 42 patients performed at Cleveland Clinic Foundation, Ohio. For this data, study of Bhaganagar et al. (2010) [1] has revealed the stenosis for 42 patients can be categorized into four types – type I (peak-valley), type II (ascending), type III (descending), and type IV (diffuse). The aim of the present study is to isolate the effect of shape of the stenosis on the flow characteristics for a given degree of the stenosis. In this study, we conduct fluid dynamic simulations for the four stenosis types (type I–IV) and analyze the differences in the flow characteristics between these types. Finely refined tetrahedral mesh for the 3-D solid model of the artery with plaques has been generated. The 3-D steady flow simulations were performed using the turbulence (k–ε) model in a finite volume based computational fluid dynamics solver. The axial velocity, the radial velocity, turbulence kinetic energy and wall shear stress profiles of the plaque have been analyzed. From the axial and radial velocity profiles results the differences in the velocity patterns are significantly visible at proximal as well as distal to the throat, region of maximum stenosis. Turbulent kinetic energy and wall shear stress profiles have revealed significant differences in the vicinity of the plaque. Additional unsteady flow simulations have been performed to validate the hypothesis of the significance of plaque morphology in flow alterations in diseased coronary artery. The results revealed the importance of accounting for plaque morphology in addition to plaque height to accurately characterize the turbulent flow in a diseased coronary artery.     

Estimation of shear wave velocity in gelatin phantoms utilizing PhS-SSOCT

We report a method for measuring shear wave velocity in soft materials using phase stabilized swept source optical coherence tomography (PhS-SSOCT). Wave velocity was measured in phantoms with various concentrations of gelatin and therefore different stiffness. Mechanical waves of small amplitudes (??10 ??m) were induced by applying local mechanical excitation at the surface of the phantom. Using the phase-resolved method for displacement measurement described here, the wave velocity was measured at various spatially distributed points on the surface of the tissue-mimicking gelatin-based phantom. The measurements confirmed an anticipated increase in the shear wave velocity with an increase in the gelatin concentrations. Therefore, by combining the velocity measurements with previously reported measurements of the wave amplitude, viscoelastic mechanical properties of the tissue such as cornea and lens could potentially be measured.     

Compensation of refocusing inefficiency with synchronized inversion sweep (CRISIS) in multiplicity-edited HSQC

Use of adiabatic pulses in broadband inversion and decoupling is well known. Replacement of the rectangular pi pulses in the INEPT and rev-INEPT parts of the HSQC and gHSQC experiments with adiabatic pulses substantially improves the sensitivity of these experiments. However, modulation of cross peak intensity in multiplicity-edited HSQC or gHSQC experiments can be quite severe. These modulations arise during the multiplicity-editing periods due to the inefficient refocusing of the spin-echo caused by the mismatch of the echo delay with the one-bond coupling constant. These modulations (which we call echo modulations) are field strength (and hence spectral width) independent. Use of adiabatic pulses with the inversion sweep synchronized to the 1H-13C coupling constant range typically observed in a 13C spectrum will provide substantial improvement in sensitivity. The inversion profile problems associated with rectangular pi pulses can be moderately compensated by composite pulse schemes and these schemes could prove to be reasonable alternatives to adiabatic pulses. However, the adiabatic sweep provides a unique method to compensate the echo modulations for multiplicity-edited experiments. The origin and the compensation of refocusing inefficiency with synchronized inversion sweep (CRISIS) method to minimize these modulations is described.     

Bimetallic Co–Ni/TiO<Subscript>2</Subscript> catalysts for selective hydrogenation of cinnamaldehyde

Bimetallic Co–Ni catalysts in the composition range Co_(1?x)Ni_x with x?=?0.0, 0.2, 0.3, 0.4, 0.5, 0.6, 0.8 and 1.0, with total metal loading of 15% w/w and supported on TiO₂-P25, have been prepared by chemical reduction of the metal acetates by glucose in aqueous alkaline medium and characterized by XRD, TEM, TPR, XPS and H₂-TPD techniques. Selective hydrogenation of cinnamaldhyde (CAL) to hydrocinnamaldehyde (HCAL), cinnamyl alcohol (COL) and hydrocinnamyl alcohol (HCOL) has been investigated at 20 bar pressure, in the temperature range 120–140 °C. Co/Ni crystallite sizes in the range 6.0?±?1 nm are observed by TEM. TPR and XPS results indicate the formation of nanoscale Co–Ni alloys, which tend to weaken M–H bond strength, as revealed by H₂-TPD measurements. Ni/TiO₂ displays very high conversion of CAL (86.9%) with high selectivity (78.7%) towards HCAL formation at 140 °C. Co/TiO₂, on the other hand, exhibits relatively lower CAL conversion (55%) and higher selectivity (61.3%) for COL formation at the same temperature. However, bi-metallic Co–Ni catalysts in the composition range x?=?0.3–0.6 display very high conversion (>?98%) due to alloy formation and weakening of M–H bonds. Bimetallic Co_0.7Ni_0.3 catalyst displays high conversion of CAL (98.1%) and high selectivity (82.9%) towards HCOL. Overall CAL hydrogenation activity at 140 °C, when expressed as TOF, displays a maximum value at the composition Co_0.5Ni_0.5. Activity and selectivity patterns have been rationalized based on the reaction pathways observed on the catalysts and the influence of Co–Ni alloy formation and M–H bond strength. Thus, a synergetic effect, originating from an appropriate composition of base metal catalysts and reaction conditions, could result in hydrogenation activity comparable with noble metal based catalysts.     

Temperature-dependent photoelectron spectroscopy of methyl benzoate anions: observation of steric effect in o-methyl benzoate

Temperature-dependent photoelectron spectra of benzoate anion (C6H5CO2(-)) and its three methyl-substituted isomers (o-, m-, p-CH3C6H4CO2(-)) have been obtained using a newly developed low-temperature photoelectron spectroscopy apparatus that features an electrospray source and a cryogenically controlled ion trap. Detachment channels due to removing electrons from the carboxylate group and benzene ring pi electrons were distinctly observed. Well-resolved vibrational structures were obtained in the lower binding energy region due to the OCO bending modes, except for o-CH3C6H4CO2(-), which yielded broad spectra even at the lowest ion trap temperature (18 K). Theoretical calculations revealed a large geometry change in the OCO angles between the anion and neutral ground states, consistent with the broad ground-state bands observed for all species. A strong steric effect was observed between the carboxylate and the methyl group in o-CH3C6H4CO2(-), such that the -CO2(-) group is pushed out of the plane of the benzene ring by approximately 25 degrees and its internal rotational barrier is significantly reduced. The low rotational barrier in o-CH3C6H4CO2(-), which makes it very difficult to be cooled vibrationally, and the strong coupling between the OCO bending and CO2 torsional modes yielded the broad PES spectra for this isomer. It is shown that there is no C-H...O hydrogen bond in o-CH3C6H4CO2(-), and the interaction between the carboxylate and methyl groups in this anion is found to be repulsive in nature.     

Negative ion electrospray ionization mass spectral study of dicarboxylic acids in the presence of halide ions

The negative ion electrospray ionization (ESI) mass spectra of a series of dicarboxylic acids, a pair of isomeric (cis/trans) dicarboxylic acids and two pairs of isomeric (positional) substituted benzoic acids, including a pair of hydroxybenzoic acids, were recorded in the presence of halide ions (F(-), Cl(-), Br(-) and I(-)). The ESI mass spectra contained [M--H](-) and [M+X](-) ions, and formation of these ions is found to be characteristic of both the analyte and the halide ion used. The analytes showed a greater tendency to form adduct ions with Cl(-) under ESI conditions compared with the other halide ions used. The isomeric compounds yielded distinct spectra by which the isomers could be easily distinguished. The collision-induced dissociation mass spectra of [M+X](-) ions reflected the gas-phase basicities of both the halide ion and [M--H](-) ion of the analyte. However, the relative ordering of gas-phase basicities of all analyte [M--H](-) and halide ions could not account for the dominance of chloride ion adducts in ESI mass spectra of the analytes mixed with equimolar quantities of the four halides.     

Electronic structure and properties of isoelectronic magic clusters: Al13X (X=H,Au,Li,Na,K,Rb,Cs)

The equilibrium structure, stability, and electronic properties of the Al(13)X (X=H,Au,Li,Na,K,Rb,Cs) clusters have been studied using a combination of photoelectron spectroscopy experiment and density functional theory. All these clusters constitute 40 electron systems with 39 electrons contributed by the 13 Al atoms and 1 electron contributed by each of the X (X=H,Au,Li,Na,K,Rb,Cs) atom. A systematic study allows us to investigate whether all electrons contributed by the X atoms are alike and whether the structure, stability, and properties of all the magic clusters are similar. Furthermore, quantitative agreement between the calculated and the measured electron affinities and vertical detachment energies enable us to identify the ground state geometries of these clusters both in neutral and anionic configurations.