Integration of hardware and software in a high-performance laboratory reactor

The assembly of a stirred tank reactor capable of precise reaction temperature control is described. The unit allows easy on-line determination of the thermal effect and calculation of heat transfer coefficients and heat capacities. Construction elements are standard, low cost, and high quality. Temperature control is achieved by a heating-cooling loop integrated to the reactor jacket and a cascade control procedure. An important feature of the equipment is the integration of the data acquisition system with the supervisory control system that allows the capability of an advanced strategy for process control and data acquisition. The capability of the reaction system is demonstrated for the microemulsion polymerization of vinyl acetate, by the use of batch and isothermal operational modes. The course of the reaction is followed on-line by the temperature variation of the jacket. Procedures are described for the calibration of the unit. The reactor developed is versatile, is easy to configure and extend, is low cost, and can compete advantageously with commercial reactor units such as the Mettler RC1. © 1996 John Wiley & Sons, Inc.     

Epoxidation reaction of trimethylolpropane with epichlorohydrin: Kinetic study of chlorohydrin formation

The kinetics of the reaction between trimethylolpropane (TMP) and epichlorohydrin (ECH) were studied. A mechanism is proposed which involves the synthesis of chlorohydrins, a previous stage which then leads to epoxy resin formation. From this mechanism a set of three coupled non-linear differential equations, (each equation corresponds to each chlorohydrin) was derived and numerical solutions were obtained using a Monte-Carlo method. The concentrations of chlorohydrins determined by this method (41.7, 35.7, and 22.5%) compare well with the experimental GPC results (42.7, 34.7, and 22.6%). The corresponding rate constants for the formation of the chlorohydrins were obtained.     

Statistical design of sustainable composites from poly(lactic acid) and grape pomace

Biocomposites from poly(lactic acid) (PLA) and grape pomace (GP) were created via injection molding to examine the effects of GP in a PLA matrix. To optimize the mechanical performance the biocomposites were compatibilized with maleic anhydride grafted PLA (MA-g-PLA). The objective of this work was to create a model that could accurately predict the mechanical properties of GP/PLA biocomposites. A region of feasibility for the biocomposites was determined using a statistical design of experiments. Linear regression was used to model the mechanical performance and predicted results with an error of 10% for both tensile and flexural strength and 16% for impact strength. The model was verified with a biocomposite of PLA/GP/MA-g-PLA with a ratio of 62/36/2. This biocomposite had a tensile strength, flexural modulus, and impact strength of 25.8 MPa, 40.0 MPa, and 18.4 J/m, respectively. It was found that a linear model can accurately predict the mechanical properties of PLA/GP/MA-g-PLA biocomposites.     

Deciphering the Complex Molecular Pathogenesis of Myotonic Dystrophy Type 1 through Omics Studies

Omics studies are crucial to improve our understanding of myotonic dystrophy type 1 (DM1), the most common muscular dystrophy in adults. Employing tissue samples and cell lines derived from patients and animal models, omics approaches have revealed the myriad alterations in gene and microRNA expression, alternative splicing, 3′ polyadenylation, CpG methylation, and proteins levels, among others, that contribute to this complex multisystem disease. In addition, omics characterization of drug candidate treatment experiments provides crucial insight into the degree of therapeutic rescue and off-target effects that can be achieved. Finally, several innovative technologies such as single-cell sequencing and artificial intelligence will have a significant impact on future DM1 research.     

Phenylvinilbisquinolines as fluorescent markers in functionalized polypropylene films

Polymer Bulletin - In this work, polypropylene films (PP) and maleic anhydride graft polypropylene (PPgMA) at different concentrations of a photoluminescent dye 2,2′-(1,4-phenylenedivinylene)...     

Sensitivity of Viscosity on Molten Ti Infusion into a B4C-Packed Bed at the Microscale

Metallurgical and Materials Transactions B - The effect of the surface tension–viscosity dissipation driving liquid Ti flow into a B4C packed bed was analyzed at 1941 K and 2573 K. The model...     

Acceleration of kinetic monte carlo simulations of free radical copolymerization: A hybrid approach with scaling

Kinetic Monte Carlo (KMC) has been widely used in the simulation of polymeric reactions. The power of KMC is highlighted by its ability to keep track of the length and sequence of every radical or polymer chain, while it is computationally more expensive than deterministic kinetic models. This paper introduces an acceleration method that significantly reduces the computational cost of KMC simulations, while keeping the same features as the full kinetic Monte Carlo simulations. Case studies are used to demonstrate the general applicability of this method to free radical copolymerization. © 2017 American Institute of Chemical Engineers AIChE J, 63: 4013–4021, 2017     

Compressive Creep of SiC-Whisker-Reinforced Al2O3

Compressive creep of SiC-whisker-reinforced Al₂O₃ composites (0, 5, 15, and 25 wt% SiC) was measured in the temperature range of 1300° to 1500°C in air and argon. The creep resistance increased with increasing whisker concentration. The results indicated that the whiskers degraded in air, increasing strain rates compared to those in argon. Stress exponents between 1.0 and 2.0 and an activation energy of 620 ± 100 kJ/mol were measured. Transmission electron microscopy observations indicated that cavitation was minimal and that the deformed composites had the same dislocation structure as did the as-received samples.     

Reactive Processing of a ZrB2 / ZrC / Zr–Si Ceramic Composite with a Controlled Oxygen Potential

A Zr–Si liquid reacted with B₄C in a graphite enclosure was configured to control the oxygen potential (10^?45 kPa) to form a ZrB₂ / ZrC / Zr – Si ceramic composite. The graphite enclosure was placed in a temperature gradient with the hot zone at >2133 K to react Zr – Si with B₄C and with the opposite end approximating 933–1000 K at the position of an aluminum melt. A ZrB₂ / ZrC / Zr – Si composite forms with the scanning‐electron microscope (SEM), microstructures showing rectangular ZrB₂ precipitates and hexagonally shaped ZrC precipitates embedded in a Zr – Si matrix.