Low-frequency Raman spectra of odd α,ω-disubstituted n-alkanes

Low-Frequency Raman spectra of odd α,ω-dibromo- and α,ω-dihydroxy-n-alkanes were recorded. The longitudinal acoustic mode (LAM-1) frequencies were assigned by references to the published results for n-alkanes and even α,ω-disubstituted n-alkanes and also by taking account of the effects of end intermolecular forces and end-group masses by use of the chain model of Minoni and Zerbi.     

Transport of ions through the oil phase of W(1)/O/W(2) double emulsions

Using a capillary video microscopy technique, the ion transport at liquid-liquid interfaces and through a surfactant-containing emulsion liquid membrane was visually studied by preparing a double emulsion globule within the confined space of a thin-walled, transparent, cylindrical microtube. NaCl and AgNO(3) were selected as the model reactants and were prepared to form a NaCl/AgNO(3) pair across the oil film. By observing and measuring the formed AgCl deposition, it was found that both Cl(-) and Ag(+) could transport through a thick oil film and Ag(+) was transported faster than Cl(-). Interestingly, the ion transport was significantly retarded when the oil film became extremely thin (<1 microm). The results suggested that the transport of ions mainly depends on the "reverse micelle transport" mechanism, in which reverse micelles with entrapped ions and water molecules can be formed in a thick oil film and their construction will get impeded if the oil film becomes extremely thin, leading to different ion transport rates in these two cases. The direction of ion transport depends on the direction of the osmotic pressure gradient across the oil film and the ion transport is independent of the oil film thickness in the investigated thick range. Ions with smaller Pauling radii are more easily entrapped into the formed reverse micelles and therefore will be transported faster through the oil film than bigger ions. Oil-soluble surfactants facilitate ion transport; however, too much surfactant in the oil film will slow down the ion migration. In addition, this study showed no support for the "molecular diffusion" mechanism of ion transport through oils.     

Reducing memory requirements of unsteady adjoint by synergistically using check-pointing and compression

The unsteady adjoint method used in gradient-based optimization in 2D and, particularly, 3D industrial problems modeled by unsteady PDEs may have significant storage requirements and/or computational cost. The reason for this is that the backward in time integration of the adjoint equations requires the previously computed instantaneous flow fields to be available at each time-step. This article proposes remedies to this problem, by extending/upgrading relevant techniques proposed by the group of authors as well as other researchers. Their applicability is wide, even if these remedies are herein demonstrated in shape optimization problems in unsteady fluid mechanics. Check-pointing is in widespread use as it reduces the memory footprint and CPU cost of the optimization with a controllable computational overhead. Alternatively, flow field time-series can be stored in a lossless or lossly compressed form. The novelty of this article is the development of a Compressed Coarse-grained Check-Pointing strategy for second-order accurate schemes in time, by optimally combining check-pointing and lossy compression. The latter includes (a) the incremental Proper Generalized Decomposition (iPGD) algorithm and (b) a hybridization of the iPGD with the ZFP and Zlib algorithms. This is implemented within OpenFOAM, which is used to solve the flow and adjoint equations and conduct the optimization, and assessed in 2D/3D aerodynamic shape optimization problems on unstructured grids. Effectiveness in data reduction, computational cost, and reconstruction accuracy are compared, vis-à-vis also to the “standard” binomial check-pointing technique after adjusting it to second-order accurate schemes in time.