Experimental estimation of the settling velocity and drag coefficient of the hollow cylindrical particles settling in non-Newtonian fluids in an annular channel

The drag coefficient data of particles settling in an annular channel is very much essential for designing different solid–fluid handling equipment, such as the fluidized bed. Experimental settling velocity, wall factor, and drag coefficient data of the hollow-cylinder particle are presented. Carboxymethyl cellulose solution has been used as the working fluid with a flow index of 0.64 ≤ n ≤ 0.91 and a consistency index of 0.31 ≤ K ≤ 1.81. The experimental results covered a wide diameter ratio range (0.14 ≤ d_eq/L ≤ 0.46), hollow cylinder inner to outer diameter ratio (0.2 ≤ d_i/d_o ≤0.8), and Reynolds number (0.05 ≤ Re ≤ 51 and 0.09 ≤ Re_∞ ≤ 55). d_eq, d_i, and d_o are the equivalent inner and outer diameters of the particle, L is the annular gap, and Re and Re_∞ are the Reynolds numbers in the presence and absence of the wall effect, respectively. The wall factor decreased, and the drag coefficient increased with d_eq/L and d_i/d_o ratios. The above parameters declined with the Reynolds number. The hollow cylinder experienced a lesser wall effect than the spherical particles settling in a non-annular channel. In some cases, the wall factor of the hollow cylinder is found to be equal to the spherical particles settling in an annular channel. The developed correlations have successfully predicted the drag coefficients of the hollow cylinder.     

Deciphering the Effect of Lysine Acetylation on the Misfolding and Aggregation of Human Tau Fragment 171IPAKTPPAPK180 Using Molecular Dynamic Simulation and the Markov State Model

The formation of neurofibrillary tangles (NFT) with β-sheet-rich structure caused by abnormal aggregation of misfolded microtubule-associated protein Tau is a hallmark of tauopathies, including Alzheimer’s Disease. It has been reported that acetylation, especially K174 located in the proline-rich region, can largely promote Tau aggregation. So far, the mechanism of the abnormal acetylation of Tau that affects its misfolding and aggregation is still unclear. Therefore, revealing the effect of acetylation on Tau aggregation could help elucidate the pathogenic mechanism of tauopathies. In this study, molecular dynamics simulation combined with multiple computational analytical methods were performed to reveal the effect of K174 acetylation on the spontaneous aggregation of Tau peptide ¹⁷¹IPAKTPPAPK¹⁸⁰, and the dimerization mechanism as an early stage of the spontaneous aggregation was further specifically analyzed by Markov state model (MSM) analysis. The results showed that both the actual acetylation and the mutation mimicking the acetylated state at K174 induced the aggregation of the studied Tau fragment; however, the effect of actual acetylation on the aggregation was more pronounced. In addition, acetylated K174 plays a major contributing role in forming and stabilizing the antiparallel β-sheet dimer by forming several hydrogen bonds and side chain van der Waals interactions with residues I171, P172, A173 and T175 of the corresponding chain. In brief, this study uncovered the underlying mechanism of Tau peptide aggregation in response to the lysine K174 acetylation, which can deepen our understanding on the pathogenesis of tauopathies.     

Radiation crosslinked polyvinyl alcohol/polyvinyl pyrrolidone/acrylic acid hydrogels: swelling,crosslinking and dye adsorption study

Iranian Polymer Journal - Hydrogels were produced from mixtures of polyvinyl alcohol (PVA), polyvinyl pyrrolidone (PVP), and acrylic acid (AAc) using γ-radiation at doses of 3, 7, and...     

Kinetics of catalytic esterification of terephthalic acid with methanol vapour

This paper describes the investigations carried out on the kinetics of the solid-gas reaction between terephthalic acid and methyl alcohol in presence of phosphoric acid as the catalyst. As phosphoric acid itself reacts with the alcohol forming methyl phosphates, the kinetic data obtained have been analysed taking this reaction into account. The rate of formation of monomethyl phosphate has been found to be proportional to the square of the mole fraction of the acid present at any instant. The activation energy involved in this reaction is 11.3 kcal/g mole. The data obtained on terephthalic acid esterification show that; (i) the conversion sharply increases with an increase in the catalyst concentration between 30–35 per cent (w/w), (ii) the ‘shrinking particle’ model, proposed by Levenspiel for solid-gas reactions, can be conveniently adapted to represent the reaction, and (iii) the temperature dependency of the reaction follows the Arrhenius law, with activation energy being 11.5 kcal/g mole.     

A model for predicting fracture resistance of fiber reinforced concrete

A theoretical model is presented to predict the crack propagation resistance of fiber reinforced cement based composites. A crack in the matrix is divided into a traction free zone, fiber bridging zone and the matrix process zone. The crack closing pressure due to fibers depends on the (Mode I) crack opening displacement (COD). A method is suggested to estimate this relationship from the pull-out tests. Although calculations of COD are based on linear elastic fracture mechanics concepts, the energy absorbed in the fiber bridging zone is included in the analysis. Theoretical results are compared with the experimental data of notched beam and double cantilever beam specimens.     

Hydrodynamics and mass transfer in a bubble column with an organic liquid

Hydrodynamic and mass transfer data in Soltrol-130 (a mixture of C₉+ iso-paraffins) were measured in a 0.305 m diameter bubble column. The gas holdup structure (i.e., the contributions to holdup from the small and large bubble fractions of the dispersion) for this hydrocarbon liquid in the churn turbulent flow regime was analyzed using the dynamic gas disengagement technique. The validity of the assumption of axially uniform gas holdup structure was checked. Literature correlations were found inadequate to explain the observed gas holdup and the volumetric mass transfer coefficients for Soltrol-130. The volumetric mass transfer coefficient per unit volume of large bubbles is shown to be independent of superficial gas velocity for the fully developed churn turbulent regime. The present hydrodynamic and mass transfer data in the churn turbulent regime should be useful in the design and scale-up of bubble columns used in organic process industries.     

Liquefaction of coal using supercritical fluid mixtures

Powhatan No. 5 and Bruceton coals were liquefied for 15–60 min at 653 K and 30 MPa in supercritical aqueous mixtures containing 10–20 wt% tetrahydroquinoline (THQ), quinoline or tetralin. The THQ-water mixtures produced the highest conversion to tetrahydrofuran (THF) soluble products (up to 74%). Tetralin-water, quinoline-water and pure water solvents gave increasingly lower yields of THF solubles. Addition of hydrogen to the quinoline-water solvent mixture increased yields slightly, but not to the level obtained using the THQ-water mixture.The yields of THF solubles in all instances depended upon the concentration of solvent in the mixture, with the 10 wt% THQ and 10 wt% tetralin (in water) giving higher yields than either 0 or 20 wt% concentrations. The nitrogen-containing solvents were chemically bonded to the THF-soluble product, as observed by g.p.c.     

A Catalyst‐Directed Remote Stereogenic Center Switch During the Site‐Selective Aldol Desymmetrization of Cyclohexanone‐Based Diketones

Site‐selectivity, differentiating members of the same functional group type on one substrate, is an emerging tactic for shortened advanced building block and biomolecule synthesis. Despite its potential, site‐selectivity remains less studied and especially so for ketone‐based substrates. During this work ketone site‐selectivity has been coupled with the chiral amine‐catalyzed aldol desymmetrization of 4‐keto‐substituted cyclohexanones, allowing three stereogenic centers to form in the aldol product while leaving the acyclic ketone unreacted. Unique here, compared to all previous 4‐substituted cyclohexanone desymmetrizations, is the first access to synthetically useful quantities of an epimeric (remote stereogenic center) aldol product. To demonstrate the value of these aldol products, we show their elaboration into eight keto‐acetonide and one keto‐lactone products. All compounds were isolated as single diastereomers and in high ee (≥96%). These efforts represent the first full characterization of aldol products with type III, Figure 2, relative stereochemistry, regardless of the enantiomer formed.