Microdroplet size prediction in microfluidic systems via artificial neural network modeling for water-in-oil emulsion formulation

In this paper, an experimental study and modeling by artificial neural networks were carried out to predict the generated microdroplet dimensionless size in a microfluidic system in order to formulate a water-in-oil emulsion. The various parameters that affect the size of microdroplets (flow rates, viscosities, surface tensions of both the two phases and the diameter of the microchannel) are studied and further grouped into dimensionless numbers; we used these numbers as input to the neural network and the dimensionless length as output. The better neural network architecture has 10 neurons in the hidden layer with a mean square error of 1.4 10^?6 and a determination’s coefficient near 1 value. The relative importance of inputs on the size of the microdroplets has been determined using the Garson algorithm and the results are in good agreement with other works.     

Synthesis,structural characterization and alcohol oxidation activity of a new mononuclear manganese(II) complex

A manganese(II) complex of 2,4,6-tris(2-pyridyl)-1,3,5-triazine (tptz) has been synthesized and characterized by single-crystal X-ray diffraction, elemental analyses, IR, and UV–Vis spectroscopic techniques. Oxidation of alcohols to their corresponding aldehydes and ketones was conducted by this catalyst using oxone (2KHSO₅·KHSO₄·K₂SO₄) as an oxidant under biphasic reaction conditions (CH₂Cl₂/H₂O) and tetra-n-butylammonium bromide as phase transfer agent under air at room temperature. Easy preparation, mild reaction conditions, high yields of the products, short reaction times, no further oxidation to the corresponding carboxylic acids, high selectivity and inexpensive reagents make this catalytic system a useful oxidation method for aliphatic and benzylic alcohols.     

New coumarin-hemiterpene ether glucosides and a structurally related phenylpropanoic acid derivative from Artemisia armeniaca

Two new coumarin-hemiterpene ether glucosides, 4'-O-(beta-D-glucopyranosyl) desoxylacarol (1), and 5-O-(beta-D-glucopyranosyl) lacarol (2), were isolated from the methanolic extract of the aerial parts of Artemisia armeniaca Lam. Their structures were established by means of spectroscopic analysis including 1H- and 2D-NMR, HRESIMS, and acid hydrolysis. In addition, a structurally related phenylpropanoic acid derivative (3) was obtained in small amounts, and its structure tentatively assigned as 3-(4-hydroxy-3-methylbutoxy)-4-methoxy melilotic acid.     

Surface-induced phase transformations: multiple scale and mechanics effects and morphological transitions

Strong, surprising, and multifaceted effects of the width of the external surface layer Δ(ξ) and internal stresses on surface-induced pretransformation and phase transformations (PTs) are revealed. Using our further developed phase-field approach, we found that above some critical Δ(ξ)(*), a morphological transition from fully transformed layer to lack of surface pretransformation occurs for any transformation strain ε(t). It corresponds to a sharp transition to the universal (independent of ε(t)), strongly increasing the master relationship of the critical thermodynamic driving force for PT X(c) on Δ(ξ). For large ε(t), with increasing Δ(ξ), X(c) unexpectedly decreases, oscillates, and then becomes independent of ε(t). Oscillations are caused by morphological transitions of fully transformed surface nanostructure. A similar approach can be developed for internal surfaces (grain boundaries) and for various types of PTs and chemical reactions.     

Polynomial integrability of the Hamiltonian systems with homogeneous potential of degree − 3

In this paper, we study the polynomial integrability of natural Hamiltonian systems with two degrees of freedom having a homogeneous potential of degree k given either by a polynomial, or by an inverse of a polynomial. For k=−2,−1,…,3,4, their polynomial integrability has been characterized. Here, we have two main results. First, we characterize the polynomial integrability of those Hamiltonian systems with homogeneous potential of degree −3. Second, we extend a relation between the nontrivial eigenvalues of the Hessian of the potential calculated at a Darboux point to a family of Hamiltonian systems with potentials given by an inverse of a homogeneous polynomial. This relation was known for such Hamiltonian systems with homogeneous polynomial potentials. Finally, we present three open problems related with the polynomial integrability of Hamiltonian systems with a rational potential.     

Linearization-based algorithms for mixed-integer nonlinear programs with convex continuous relaxation

We present two linearization-based algorithms for mixed-integer nonlinear programs (MINLPs) having a convex continuous relaxation. The key feature of these algorithms is that, in contrast to most existing linearization-based algorithms for convex MINLPs, they do not require the continuous relaxation to be defined by convex nonlinear functions. For example, these algorithms can solve to global optimality MINLPs with constraints defined by quasiconvex functions. The first algorithm is a slightly modified version of the LP/NLP-based branch-and-bouund \((\text{ LP/NLP-BB })\) algorithm of Quesada and Grossmann, and is closely related to an algorithm recently proposed by Bonami et al. (Math Program 119:331–352, 2009). The second algorithm is a hybrid between this algorithm and nonlinear programming based branch-and-bound. Computational experiments indicate that the modified LP/NLP-BB method has comparable performance to LP/NLP-BB on instances defined by convex functions. Thus, this algorithm has the potential to solve a wider class of MINLP instances without sacrificing performance.     

Reversibly Switchable Fluorescent Molecular Systems Based on Metallacarborane–Perylenediimide Conjugates

Icosahedral metallacarboranes are θ-shaped anionic molecules in which two icosahedra share one vertex that is a metal center. The most remarkable of these compounds is the anionic cobalt-based metallacarborane [Co(C₂B₉H₁₁)₂]⁻, whose oxidation-reduction processes occur via an outer sphere electron process. This, along with its low density negative charge, makes [Co(C₂B₉H₁₁)₂]⁻ very appealing to participate in electron-transfer processes. In this work, [Co(C₂B₉H₁₁)₂]⁻ is tethered to a perylenediimide dye to produce the first examples of switchable luminescent molecules and materials based on metallacarboranes. In particular, the electronic communication of [Co(C₂B₉H₁₁)₂]⁻ with the appended chromophore unit in these compounds can be regulated upon application of redox stimuli, which allows the reversible modulation of the emitted fluorescence. As such, they behave as electrochemically-controlled fluorescent molecular switches in solution, which surpass the performance of previous systems based on conjugates of perylendiimides with ferrocene. Remarkably, they can form gels by treatment with appropriate mixtures of organic solvents, which result from the self-assembly of the cobaltabisdicarbollide-perylendiimide conjugates into 1D nanostructures. The interplay between dye π-stacking and metallacarborane electronic and steric interactions ultimately governs the supramolecular arrangement in these materials, which for one of the compounds prepared allows preserving the luminescent behavior in the gel state.     

Grid‐independent depth‐averaged simulations with a collocated unstructured finite volume scheme

In this article, the depth‐averaged transport equations are written in a new way so that it is possible to solve the transport equations for very small water depths. Variables are interpolated into the cell face with two different schemes and, the schemes are compared in terms of computational cost and accuracy. The bed source terms are computed using two different assumptions. The effect of these assumptions on numerical simulations is then investigated. Solutions of transport equations on different types of unstructured triangular grids are compared and, an appropriate choice of grid is suggested. Copyright © 2011 John Wiley & Sons, Ltd.     

Nuclear data for the cyclotron production of ~（117）Sb and ~（90）Nb

This presented study is to make comparison of cross sections to produce ¹¹⁷Sb and ⁹⁰Nb via different reactions with particle incident energy up to 70 MeV as a part of systematic studies on particle-induced activations on enriched Sn, Y₂O₃ and ZrO₂ targets, theoretical calculation of production yield, calculation of required thickness of target and suggestion of optimum reaction to produce Antimony-117 and Niobium-90.