A numerical model of light adjustable lens

We model numerically the mechanical effects of UV induced photo-polymerization in elastomeric artificial lens. The elastomer is originated upon cross-linking of a silicone matrix. UV irradiation of one side of the lens polymerizes selectively a photosensitive macromer, causing local variations of its concentration. The subsequent diffusion of macromers from high concentration to low concentration zones modifies the shape of the lens and thus its dioptric power. In vitro experiments on artificial lens showed that the power change is dependent on UV exposure time, irradiation intensity and light pattern. With the aim to define a numerical tool able to predict the dioptric power adjustment as a function of the UV irradiation parameters, we setup a purely mechanic finite element model of the lens, adopting a hyperelastic material model embedded with eigen-deformations. Numerical simulations of axis-symmetric irradiation closely reproduced the experimental results, in terms of both lens geometry and dioptric power, for positive, negative and lock-in corrections.     

Influence of nitrogen uptake and heat treatment on the microstructural characteristics and corrosion performance of X190CrVMo20-4-1 steel produced by supersolidus liquid-phase sintering

Martensitic stainless steel powder exhibits a high nitrogen uptake when densified by supersolidus liquid-phase sintering in a nitrogen atmosphere, but the optimum uptake, which is beneficial to its resistance to corrosion, is unknown. In this study, the resistance of high-carbon martensitic stainless steel X190CrVMo20-4-1 densified in a nitrogen atmosphere against pitting corrosion was explored. This was to clarify the impact of nitrogen uptake in the steel matrix in the quenched and tempered condition on its corrosion resistance in an aqueous solution. Samples were subjected to potentiodynamic polarisation tests in a de-aerated, 1 wt% NaCl solution. Results revealed that the X190 steel densified in a nitrogen atmosphere at 40-kPa pressure, subjected to deep cryogenic treatment in liquid nitrogen at an austenitising temperature of 1150°C and tempered at 200°C, had the best pitting corrosion resistance with a breakdown potential of 142 ± 11 mV/SCE and a hardness of 738 ± 4 HV10. The matrix around the M₇C₃ carbides and MX carbonitrides suffered high pitting susceptibility. The implications of this study serve as a basis for the improvement of the functional properties of steels.     

An experimental investigation on the influence of phenol on the solubility of CO2 in aqueous solutions of NaOH

Experimental results are presented for the solubility of CO₂ in an aqueous solution of phenol and NaOH (molalties in water: phenol: 0.5; NaOH: 1.0) at (314, 354, and 395) K and pressures up to 10 MPa. The experimental work extends recent investigations on the influence of phenol as well as of (phenol + NaCl) on the solubility of CO₂ in water. In contrast to those previous investigations, the strong electrolyte reacts with carbon dioxide and also with phenol. The experimental results are compared with predictions from a thermodynamic model. That model combines a model for the “chemical” solubility of CO₂ in aqueous solutions of NaOH with a model for the “physical” solubility of CO₂ in aqueous solutions of phenol. An extension is introduced to account for the chemical reaction between the weak acid phenol and the strong base sodium hydroxide. The prediction results nicely agree with the new experimental data. © 2015 American Institute of Chemical Engineers AIChE J, 61: 2832–2840, 2015     

Modeling heterogeneous bacterial populations exposed to antibiotics: The logistic‐dynamics case

In typical in vitro tests for clinical use or development of antibiotics, samples from a bacterial population are exposed to an antibiotic at various concentrations. The resulting data can then be used to build a mathematical model suitable for dosing regimen design or for further development. For bacterial populations that include resistant subpopulations—an issue that has reached alarming proportions—building such a model is challenging. In prior work, we developed a related modeling framework for such heterogeneous bacterial populations following linear dynamics when exposed to an antibiotic. We extend this framework to the case of logistic dynamics, common among strongly resistant bacterial strains. Explicit formulas are developed that can be easily used in parameter estimation and subsequent dosing regimen design under realistic pharmacokinetic conditions. A case study using experimental data from the effect of an antibiotic on a gram‐negative bacterial population exemplifies the usefulness of the proposed approach. © 2015 American Institute of Chemical Engineers AIChE J, 61: 2385–2393, 2015     

Microtexture Analysis of the Alumina Scale in Thermal Barrier Coatings

Transmission electron microscopy‐based grain orientation mapping method was employed to investigate the microtexture of the alumina scale formed in commercial thermal barrier coatings (TBCs) with two standard types of Pt‐enriched bond coats. Reliable orientation/phase maps with a spatial resolution down to 2 nm were acquired on the alumina grains. It was observed that the alumina scale on the Pt‐aluminide β‐phase bond coat has a stronger c‐axis texture normal to the bond coat surface, in comparison with that on the Pt‐diffused γ/γ′‐phase bond coat. The microtexture of the alumina scale could affect its effective coefficient of thermal expansion, which is a contributor to the severity of the bond coat rumpling mechanism of TBCs failure.     

Drop printing of pharmaceuticals: Effect of molecular weight on PEG coated‐naproxen/PEG 3350 solid dispersions

Solid dispersions have been used to enhance the bioavailability of poorly water‐soluble active pharmaceutical ingredients (APIs). However, the solid‐state phase, compositional uniformity, and scale‐up problems are issues that need to be addressed. To allow for highly controllable products, the drop printing (DP) technique can provide precise dosages and predictable compositional uniformity of APIs in two‐/three‐dimensional structures. DP was used to prepare naproxen (NAP)/polyethylene glycol 3350 (PEG 3350) solid dispersions with PEG coatings of different molecular weights (MWs). A comparison of moisture‐accelerated crystallization inhibition by different PEG coatings was assessed. Scanning electron microscopy, second harmonic generation microscopy, and differential scanning calorimetry analysis were performed to characterize the morphology and quantify the apparent crystallinity of NAP within the solid dispersions. Thermogravimetric analysis was employed to measure the water content within each sample. The results suggest that the moisture‐accelerated crystallization inhibition capability of the PEG coatings increased with increasing MW of the PEG coating. Besides, to demonstrate the flexibility of DP technology on manufacturing formulation, multilayer tablets with different PEG serving as barrier layers were also constructed, and their dissolution behavior was examined. By applying DP and appropriate materials, it is possible to design various carrier devices used to control the release dynamics of the API. © 2015 American Institute of Chemical Engineers AIChE J, 61: 4502–4508, 2015     

Accuracy and optimal sampling in Monte Carlo solution of population balance equations

Implementation of a Monte Carlo simulation for the solution of population balance equations (PBEs) requires choice of initial sample number (N₀), number of replicates (M), and number of bins for probability distribution reconstruction (n). It is found that Squared Hellinger Distance, H², is a useful measurement of the accuracy of Monte Carlo (MC) simulation, and can be related directly to N₀, M, and n. Asymptotic approximations of H² are deduced and tested for both one‐dimensional (1‐D) and 2‐D PBEs with coalescence. The central processing unit (CPU) cost, C, is found in a power‐law relationship, , with the CPU cost index, b, indicating the weighting of N₀ in the total CPU cost. n must be chosen to balance accuracy and resolution. For fixed n, M × N₀ determines the accuracy of MC prediction; if b > 1, then the optimal solution strategy uses multiple replications and small sample size. Conversely, if 0 < b < 1, one replicate and a large initial sample size is preferred. © 2015 American Institute of Chemical Engineers AIChE J, 61: 2394–2402, 2015     

Evaluation of high temperature polymers in nanolayered films and gradient refractive index (GRIN) lenses

A new polymer nanolayer gradient refractive index (GRIN) system with more robust thermal stability because of incorporation of a high glass transition temperature polyester, OKP4HT, was demonstrated. A combination of extruded nanolayered GRIN film systems, comprised of five unique polymer materials, were combined to produce laminate optics comprised of a large internal refractive index gradient distribution, n = 1.445 – 1.630, without degradation of optical transmissive properties. The optical performance of a series of varied magnitude GRIN lenses, ranging from Δn = 0 to 0.185, was evaluated. Increasing the lens refractive index range resulted in decreased optic sphericalaberrations that followed analytical predictions. An analytical approach was reported to correlate the polymer material upper service temperature (UST) to the onset of polymer material loss modulus as measured by DMTA. Thermo‐optical interferometry measurements of irreversible lens deformation confirmed the lenses UST at 125°C for the OKP4HT/PC system as compared to 75°C for a PMM/SAN17 system. © 2015 Wiley Periodicals, Inc. J. Appl. Polym. Sci. 2015 , 132, 42741.