A direct comparison between volume and surface tracking methods with a boundary-fitted coordinate transformation and third-order upwinding

A Volume Tracking (VT) and a Front Tracking (FT) algorithm are implemented and compared for locating the interface between two immiscible, incompressible, Newtonian fluids in a tube with a periodically varying, circular cross-section. Initially, the fluids are stationary and stratified in an axisymmetric arrangement so that one is around the axis of the tube (core fluid) and the other one surrounds it (annular fluid). A constant pressure gradient sets them in motion. With both VT and FT, a boundary-fitted coordinate transformation is applied and appropriate modifications are made to adopt either method in this geometry. The surface tension force is approximated using the continuous surface force method. All terms appearing in the continuity and momentum equations are approximated using centered finite differences in space and one-sided forward finite differences in time. In each time step, the incompressibility condition is enforced by a transformed Poisson equation, which is linear in pressure. This equation is solved by either direct LU decomposition or a Multigrid iterative solver. When the two fluids have the same density, the former method is about 3.5 times faster, but when they do not, the Multigrid solver is as much as 10 times faster than the LU decomposition. When the interface does not break and the Reynolds number remains small, the accuracy and rates of convergence of VT and FT are comparable. The well-known failure of centered finite differences arises as the Reynolds number increases and leads to non-physical oscillations in the interface and failure of both methods to converge with mesh refinement. These problems are resolved and computations with Reynolds as large as 500 converged by approximating the convective terms in the momentum equations by third-order upwind differences using Lagrangian Polynomials. When the volume of the core fluid or the Weber number decrease, increasing the importance of interfacial tension and leading to breakup of the interface forming a drop of core fluid, the FT method converges faster with mesh refinement than the VT method and upwinding may be required. Finally, examining the generation of spurious currents around a stationary “bubble” in the tube for Ohnesorge numbers between 0.1 and 10 it is found that the maximum velocity remains approximately the same in spite mesh refinements when VT is applied, whereas it is of the same order of magnitude for the coarsest mesh and monotonically decreases with mesh refinement when FT is applied.     

A survey on algorithmic approaches for solving tourist trip design problems

The tourist trip design problem (TTDP) refers to a route-planning problem for tourists interested in visiting multiple points of interest (POIs). TTDP solvers derive daily tourist tours, i.e., ordered visits to POIs, which respect tourist constraints and POIs attributes. The main objective of the problem discussed is to select POIs that match tourist preferences, thereby maximizing tourist satisfaction, while taking into account a multitude of parameters and constraints (e.g., distances among POIs, visiting time required for each POI, POIs visiting days/hours, entrance fees, weather conditions) and respecting the time available for sightseeing on a daily basis. The aim of this work is to survey models, algorithmic approaches and methodologies concerning tourist trip design problems. Recent approaches are examined, focusing on problem models that best capture a multitude of realistic POIs attributes and user constraints; further, several interesting TTDP variants are investigated. Open issues and promising prospects in tourist trip planning research are also discussed.     

Improving the CBS‐based partitioned semi‐implicit coupling algorithm for fluid‐structure interaction

We detail in this work 2 simple but effective alternatives to improve the characteristic‐based split–based partitioned semi‐implicit coupling algorithm for fluid‐structure interaction. The basic idea lies in introducing the end‐of‐step velocity into the implicit stages of the 2 algorithms integrating different splits. The algorithm built upon the second‐order pressure split is further stabilized via the pressure gradient projection with particular emphasis on the extremely low mass ratio. The smoothed finite element method is exploited for spatial discretization of fluid and solid equations. Even without any accelerators, both the semi‐implicit solvers incorporating fixed‐point iterations engender visible improvements versus the previously published data for several benchmarks.     

Isotopic Traceability (13C and 18O) of Greek Olive Oil

In recent years, isotopic analysis has been proven a valuable tool for the determination of the origin of various materials. In this article, we studied the ¹⁸O and ¹³C isotopic values of 210 olive oil samples that were originated from different regions in Greece in order to verify how these values are affected by the climate regime. We observed that the δ¹⁸O isotopic values range from 19.2 ‰ to 25.2 ‰ and the δ¹³C values range from −32.7 ‰ to −28.3 ‰. These differences between the olive oils’ isotopic values depended on the regional temperature, the meteoric water, and the distance from the sea. Furthermore, we studied the ¹³C isotopic values of biophenolic extracts, and we observed that they have same capability to differentiate the geographic origin. Finally, we compared the isotopic values of Greek olive oils with samples from Italy, and we concluded that there is a great dependence of oxygen isotopes on the climatic characteristics of the different geographical areas.     

Free‐Radical Dispersion Polymerization of Methyl Methacrylate in Supercritical Carbon Dioxide: A Parametric Analysis with Reaction Calorimetry

In an attempt to reduce the emission of hazardous VOCs, SCFs have been intensively investigated as alternative solvents during the last two decades. In this study, the application of reaction calorimetry, an efficient tool to obtain kinetic and safety data, is presented on the free radical dispersion polymerization of MMA in scCO₂. The effect of three major parameters with respect to the reaction evolution are studied, namely of stirrer type and stirring speed, the monomer and CO₂ concentration and the stabilizer concentration. The effective formation of the dispersion as well as the balance between the polymer formed in the continuous phase or inside the particles are key features of this analysis.

     

Biocatalytic Pathway Selection in Transient Tripeptide Nanostructures

Structural adaption in living systems is achieved by competing catalytic pathways that drive assembly and disassembly of molecular components under the influence of chemical fuels. We report on a simple mimic of such a system that displays transient, sequence‐dependent formation of supramolecular nanostructures based on biocatalytic formation and hydrolysis of self‐assembling tripeptides. The systems are catalyzed by α‐chymotrypsin and driven by hydrolysis of dipeptide aspartyl‐phenylalanine‐methyl ester (the sweetener aspartame, DF‐OMe). We observed switch‐like pathway selection, with the kinetics and consequent lifetime of transient nanostructures controlled by the peptide sequence. In direct competition, kinetic (rather than thermodynamic) component selection is observed.     

Magnetic octadecyl‐based matrix solid‐phase dispersion coupled with gas chromatography with mass spectrometry in a proof‐of‐concept determination of multi‐class pesticide residues in carrots

A novel procedure is put forward based on the combination of the well‐established matrix solid‐phase dispersion and the magnetic and sorption properties of magnetic octadecyl in the presence of n‐octanol and was employed in a proof‐of‐concept sample preparation and determination of several classes of pesticide residues in carrots. The procedure does not require the transfer of blend to cartridge and subsequent packing, nor any co‐sorbent for extract clean up. The hydrophobic magnetic nanoparticles utilized as a sorbent, can be retrieved by n‐octanol under the application of a magnetic field due to hydrophobic interactions. Elution of pesticide residues is then carried out with an organic solvent. A total of 26 pesticides were included in this procedure and the target compounds were analyzed using gas chromatography with mass spectrometry in the selective ion monitoring mode. The average extraction recoveries obtained from carrot samples fortified at three different concentrations (20, 50, and 500 μg/kg) were 77–107%. The estimated limits of quantitation for most target analytes were in the low μg/kg level. The study demonstrates that the proposed extraction procedure is simple and effective, avoiding a clean‐up step for the sample preparation of vegetable.