Towards the Development of an Evolution Equation for Flame Turbulence Interaction in Premixed Turbulent Combustion

Flame turbulence interaction is one of the leading order terms in the scalar dissipation \(\left (\widetilde {\varepsilon }_{c}\right )\) transport equation [35] and is thus an important phenomenon in premixed turbulent combustion. Swaminathan and Grout [36] and Chakraborty and Swaminathan [15, 16] have shown that the effect of strain rate on the transport of \(\widetilde {\varepsilon }_{c}\) is dominated by the interaction between the fluctuating scalar gradients and the fluctuating strain rate, denoted here by \(\overline {\rho }\widetilde {\Delta }_{c}= \overline {\rho {\alpha }\nabla c^{\prime \prime }S_{ij}^{\prime \prime }\nabla c^{\prime \prime }}\) ; this represents the flame turbulence interaction. In order to obtain an accurate representation of this phenomenon, a new evolution equation for \(\widetilde {\Delta }_{c}\) has been proposed. This equation gives a detailed insight into flame turbulence interaction and provides an alternative approach to model the important physics represented by \(\widetilde {\Delta }_{c}\) . The \(\widetilde {\Delta }_{c}\) evolution equation is derived in detail and an order of magnitude analysis is carried out to determine the leading order terms in the \(\widetilde {\Delta }_{c}\) evolution equation. The leading order terms are then studied using a Direct Numerical Simulation (DNS) of premixed turbulent flames in the corrugated flamelet regime. It is found that the behaviour of \(\widetilde {\Delta }_{c}\) is determined by the competition between the source terms (pressure gradient and the reaction rate), diffusion/dissipation processes, turbulent strain rate and the dilatation rate. Closures for the leading order terms in \(\widetilde {\Delta }_{c}\) evolution equation have been proposed and compared with the DNS data.     

Coordination modes of novel rhodanine azodye complexes.

The reaction products of metal(II) salts with 5-sulphamethoxazoleazo-3-phenyl-2-thioxo-4-thiazolidinone (H2L) have been characterized by elemental analyses, magnetic susceptibility, electronic, infrared and electron paramagnetic resonance spectral measurements. The spectral data suggest a square pyramidal structure for Cu(II) and Co(II) complexes and an octahedral for Ni(II) complexes. Various EPR parameters have been calculated. From the electron paramagnetic resonance and spectral data, the orbital reduction factors were calculated. In all case kperpendicular > kparallel which indicates a 2B1g ground state. These five coordinated complex of Cu(II) react further with pyridine forming six coordinate base adduct. The different modes of chelation of the ligand and stereochemistry around the metal ion are discussed.     

Effect of layer sliding on the interfacial electronic properties of intercalated silicene/indium selenide van der Waals heterostructure

Methods capable of tuning the properties of van der Waals (vdW) layered materials in a controlled and reversible manner are highly desirable. Interfacial electronic properties of two-dimensional vdW heterostructure consisting of silicene and indium selenide (InSe) have been calculated using density functional theory-based computational code. Furthermore, in order to vary the aforementioned properties, silicene is slid over a InSe layer in the presence of Li intercalation. On intercalation of the heterostructure, the buckling parameter associated with the corrugation of silicene decreases from 0.44 Å to 0.36 Å, whereas the InSe structure remains unaffected. Potential energy scans reveal a significant increase in the sliding energy barrier for the case of intercalated heterostructure as compared with the unintercalated heterostructure. The sliding of the silicene encounters the maximum energy barrier of 0.14 eV. Anisotropic analysis shows the noteworthy differences between calculated in-plane and out-of-plane part of dielectric function. A variation of the planar average charge density difference, dipole charge transfer and dipole moment have been discussed to elucidate the usability spectrum of the heterostructure. The employed approach based on intercalation and layer sliding can be effectively utilized for obtaining next-generation multifunctional devices.     

Impact of composition ratio on the structure and optical properties of (1-x)MnFe2O4/(x)ZnMn2O4 nanocomposite

($1-x$)MnFe$_{2}$O$_{4}$ (MFO)/$x$ZnMn$_{2}$O$_{4}$ (ZMO) ($x=0$, 0.2, 0.5, 0.8, and 1.0) nanocomposite samples were prepared using co-precipitation procedure. The phase percentage, cell parameters, and crystallite size of MFO and ZMO phases in each nanocomposite sample were calculated using Rietveld refinement procedure. The x-ray diffraction (XRD) analysis and Fourier-transform infrared spectroscopy techniques established the variation in the lattice parameters of each phase are due to permutation of all cations among the octahedral and tetrahedral sites of MFO and ZMO. The different oxidation states of different ions in all samples were determined using x-ray photoelectron spectroscopy (XPS) technique. The variation in absorbance of the nanocomposite samples with composition parameter ($x$) is dependent on the wavelength region. The optical bandgap of the nanocomposite samples is decreased as the content of ZMO phase increased. The effect of alloying on the refractive index, extinction coefficient, dielectric constant, optical conductivity, and the nonlinear optical behaviors of all samples were studied in detail. The nanocomposite sample $x=0.5$ disclosed upgraded optical parameters with the highest refractive index, optical conductivity, and PL intensity, which nominate it to be functional in various application fields.     

A technique for digital steganography using chaotic maps

Chaos has been applied extensively in secure communication over the last decade, but most of the chaotic security protocols defined, are cryptographically weak or slow to compute. Also, study of chaotic phenomena as application in security area is not discussed in detail. In this paper, we have intensely studied chaos, their influence in secure communications and proposed a steganography technique in spatial domain for digital images based upon chaotic maps. By applying chaos effectively in secure communication, the strength of the overall anticipated algorithm has been increased to a significant level. In addition, few security statistical analyses such as correlation, entropy, energy, contrast, homogeneity, peak signal to noise ratio, and mean square error have also been carried out and shown that it can survive against various differential attacks such as the known message attack, known cover attack, known stego attack, and stego only attack.     

A heat transfer model for incorporating carbon foam fabrics in firefighter’s garment

In the present work, a numerical study was performed to predict and investigate the performance of a thermal protection system for firefighter’s garment consisting of carbon foam fabric in both the outer shell and the thermal liner elements. Several types of carbon foam with different thermal conductivity, porosity, and density were introduced to conduct a parametric study. Additionally, the thickness of the introduced carbon foam fabrics was varied to acquire optimum design. Simulation was conducted for a square planar 2D geometry of the clothing comprising of different fabric layers and a double precision pressure-based implicit solver, under transient state condition was used. The new anticipated thermal protection system was tested under harsh thermal environmental conditions that firefighters are exposed to. The parametric study showed that employing carbon foam fabric with one set of designed parameters, weight reduction of 33 % in the outer shell, 56 % in the thermal liner and a temperature reduction of 2 % at the inner edge of the garment was achieved when compared to the traditional firefighter garment model used by Song et al. (Int J Occup Saf Ergon 14:89–106, 2008). Also, carbon foam fabric with another set of designed parameters resulted in a weight reduction of 25 % in the outer shell, 28 % in the thermal liner and a temperature reduction of 6 % at the inner edge of the garment. As a result, carbon foam fabrics make the firefighter’s garment more protective, durable, and lighter in weight.     

KO(t)Bu mediated synthesis of phenanthridinones and dibenzoazepinones

Synthesis of substituted phenanthridinones and dibenzoazepinones has been realized from 2-halo-benzamides in the presence of potassium tert-butoxide and a catalytic amount of 1,10-phenanthroline or AIBN. This new carbon-carbon bond forming reaction gives direct access to various biaryl lactams containing six- and seven-membered rings chemoselectively. Carbon-carbon coupling seems to proceed by the generation of a radical in the amide ring which leads to C-H arylation of aniline.     

Anti-HIV-1 and cytotoxicity of the alkaloids of Erythrina abyssinica Lam. growing in Sudan

Erythrina abyssinica Lam. is an important medicinal plant growing in Sudan; its seeds were investigated for the first time for their alkaloidal constituents and biological activity. The in vitro cytotoxicity of the crude alkaloidal fraction (CAF) against the cell lines HeLa, Hep-G2, HEP-2, HCT116, MCF-7 and HFB4 showed promising activity, with IC?? values of 13.8, 10.1, 8.16, 13.9, 11.4 and 12.2?μg?mL?1, respectively. Doxorubicin (positive control) showed in vitro cytotoxic activity with IC?? values 3.64, 4.57, 4.89, 3.74, 2.97 and 3.96?μg?mL?1, respectively. Bioassay-guided fractionation and isolation of the CAF led to the isolation of five Erythrina alkaloids, identified as erythraline, erysodine, erysotrine, 8-oxoerythraline and 11-methoxyerysodine. These were evaluated for their in vitro cytotoxic activity against Hep-G2 which resulted in IC?? values 17.60, 11.80, 15.80, 3.89 and 11.40?μg?mL?1, respectively. Furthermore, in vitro cytotoxic activity against HEP-2 was evaluated, which resulted in IC?? values 15.90, 19.90, 21.60, 18.50 and 11.50?μg?mL?1, respectively. The CAF caused a reduction in the viability of mock-infected MT-4 cells with a CC?? of 53?μM and a 50% protection of MT-4 cells against HIV-1 induced cytopathogeneticy with a EC?? of >53?μM, compared with EFV as a positive control, which had a CC?? of 45?μM and an EC?? of 0.003?μM. We concluded that the isolated alkaloids were responsible for the carcinogenic actions of the plant extract previously reported in the literature.     

Dual labeling of biomolecules using MeCAT and DOTA derivatives: application to quantitative proteomics

In this study, single and dual labeling of primary amino and thiol groups of target peptides is presented as a proof of concept. The proposed method allows flexible, independent and sequential labeling of the mentioned residues using lanthanides introduced via DOTA-complexes (1,4,7,10-tetraazacyclododecane-1,4,7,10-tetraacetic acid). The efficiency of the method was optimized using cysteine-containing standard peptides and then applied to bovine serum albumin (BSA) and human serum albumin (HSA) to demonstrate qualitative and quantitative aspects of this strategy. For amino labeling, cysteinyl peptides were immobilized on Sepharose-6B resin and labeled with DOTA-NHS ester followed by metallation with lanthanides. Thiol labeling was carried out using lanthanide-containing metal-coded affinity tags (MeCAT) after elution of peptides from the resin. Complete dual labeling of the standard peptides was demonstrated by liquid chromatography electrospray ionization mass spectrometry, whereas more than 80% of the detected peptides of BSA and HSA were completely dual-labeled. Parallel detection by LC coupled to inductively coupled plasma mass spectrometry (ICP-MS) delivered reliable quantitative information. Thus, the versatile lanthanide choice in both labeling steps allowed estimating primary amino and thiol stoichiometries for the studied samples using different lanthanides. On the other hand, enhancement of ICP-MS signal was achieved as expected when all positions were labeled with the same lanthanide. Finally, linear calibrations of the signal for most of the labeled peptides by standard additions of digested BSA showed a suitable behaviour for quantitative applications and demonstrated the pre-concentration capability of the employed resin.