Thermoelectric properties of n-type Bi2Te3 alloys produced by a combined process of magnetic pulsed compaction (MPC) and spark plasma sintering (SPS)

In this study, n-type 95 %Bi₂Te₃-5 %Bi₂Se₃ thermoelectric materials have been produced by a combined process of gas atomization with subsequent magnetic pulsed compaction and spark plasma sintering, and then we investigated the behavior of transport properties with sintering temperature. The microstructural observation was performed by optical microscopy and scanning electron microscopy. The crystal structures were analyzed by X-ray diffractometer. The mechanical properties were calculated by measuring the density and micro-Vickers hardness of the samples. It was found that with increasing sintering temperature the gaps between powder particles decreases and the grain sizes were coarsened. The mechanical properties shows higher values along the parallel direction compared to the perpendicular direction to the pressing. The transport properties of the thermoelectric material were investigated with variation of the sintering temperatures. The maximum power factor 1.7 × 10^?3 Wm^?1 K^?2 was measured at the sintering temperature of 450 °C.     

Design,synthesis, photochromism and electrochemistry of a novel material with pendant photochromic units

In the present work, the synthesis, photochromism and electrochemistry of a novel material 1, 1-(4-[3,4-bis(2,5-dimethyl-3-thienyl)cyclopent-3-en-1-yl]phenyl)-2,5-di-2-thienyl-1H-pyrrole, with pendant dithienylethene (DTE) photochromic units are described. It should be noted that the system 1 can be reversibly and efficiently switched between open (1o) and closed (1c) states by light in both solution and in the solid poly(methyl methacrylate) matrix. It is also noteworthy that the two isomers (1o and 1c) of this novel system 1 can be smoothly polymerized on ITO by electrochemical means. Surprisingly, the DTE unit in 1 does not retain its photochemical switching properties after immobilization onto ITO. The morphology of the polymer film was investigated by AFM analysis. Furthermore, it was found that the polymer exhibited remarkable electrochromic features that can be switched from green in the neutral state to violet state under applied external potentials without disturbing the photochromic units.     

Thermal Decomposition Kinetics of Some Metal Complexes of 2,3-Hydroxyimino-4-phenyl-6-phenyazo-1-thia-4,5-diazacyclohexa-5-diene

The Ni(II), Cu(II) Co(II) and Zn(II) complexes of 2,3‐hydroxyimino‐4‐phenyl‐6‐phenyazo‐1‐thia‐4,5‐diaza‐ cyclohexa‐5‐diene (H₂L) were synthesized. Thermal behavior of these complexes was studied in dynamic nitrogen atmosphere by TA (thermogravimetric analysis), DTA (differential thermal analysis) and DTG (differential thermal gravimetry) techniques. The reaction order, the activation energies, the entropies, the enthalpies, the free energies, and the pre‐exponential factors of the thermal decomposition reactions were calculated from the thermogravimetric curves. The kinetic analysis of the thermogravimetric data was performed by using several methods such as MacCallum‐Tanner (MT), van Krevelen (vK), Madhusudanan‐Krishnan‐Ninan (MKN), Wanjun‐Yuwen‐Hen‐Cunxin (WYHC), Horowitz‐Metzger (HM) and Coats‐Redfern method (CR) based on the single heating rate. Most appropriate methods were determined for each decomposition step according to the least‐square linear regression. The Ni(II), Cu(II) Co(II) and Zn(II) complexes displayed one‐ or two‐stage decomposition pattern when heating in a dynamic nitrogen atmosphere and metal oxides remained as end products of the complexes. The characterization of the end products of the decomposition was performed by X‐ray diffraction.     

4-[(3-Bromo-4-hydroxy­phenyl)­amino]-6,7-di­methoxyquinazolin-1-ium chloride methanol solvate and 4-­[(3-hydroxy­phenyl)­amino]-6,7-di­methoxy-1-quinazolinium chloride

The title compounds, C₁₆H₁₅BrN₃O₃⁺·Cl⁻·CH₄O (WHI–P154) and C₁₆H₁₆N₃O₃⁺·Cl⁻ (WHI–P180), are potent inhibitors [WHI–P154 with IC₅₀ = 5.6 µM and WHI–P180 with IC₅₀ = 4.0 µM for epidermal growth factor receptor (EGFR) kinase inhibition] of the EGFR tyrosine kinase as well as Janus Kinase 3. The molecular structures of these compounds are very similar except for the dihedral angle between the anilino and quinazoline moieties which is 1.10 (5)° for WHI–P154, and 45.66 (6) and 25.29 (7)° for the two mol­ecules of WHI–P180 in the asymmetric unit. The nitro­gen at the N3 position is protonated in both structures and participates in hydrogen bonding with the chlorine anions.     

Retrieving seasonally adjusted quarterly growth rates from annual growth rates that are reported quarterly

Most macroeconomic time series are reported on a quarterly basis. However, in many cases, official statistical agencies report annual (or ‘year-on-year’) growth rates rather than the quarterly data themselves. In this paper, we demonstrate how to recover seasonally adjusted quarterly growth rates from annual growth rates that are reported quarterly. As an illustration, we apply the technique to the highly seasonal UK Retail Sales series. Using only the annual growth rates calculated from the underlying data, we find that our procedure generates estimated seasonally adjusted quarterly growth rates that are almost indistinguishable from the ‘true’ seasonally adjusted quarterly growth rates.     

Novel metal complexes containing 6-methylpyridine-2-carboxylic acid as potent α-glucosidase inhibitor: synthesis,crystal structures,DFT calculations,and molecular docking

Molecular Diversity - The World Health Organization (WHO) report shows that diabetes mellitus (DM) will be one of the ten deadly diseases in the near future. The best way to prevent DM is to...     

Enantioselective synthesis of cyclic, quaternary oxonitriles

Quaternary oxonitriles are stereoselectively generated from the union of five-, six-, and seven-membered 2-chloroalkenecarbonitriles with chiral alcohols via a Claisen rearrangement. The strategy rests on a new conjugate addition-elimination of allylic alkoxides to 2-chlorocycloalkenecarbonitriles to afford substituted 2-alkoxyalkenenitriles. Subsequent thermolysis unmasks a cyclic oxonitrile while selectively forming a new quaternary center with enantiomeric ratios typically greater than 9:1. The overall alkylation strategy addresses the challenge of enantioselectively generating hindered, quaternary centers while simultaneously installing ketone, nitrile, and olefin functionalities.     

A discrete artificial bee colony algorithm for the multi-objective flexible job-shop scheduling problem with maintenance activities

This paper presents a novel discrete artificial bee colony (DABC) algorithm for solving the multi-objective flexible job shop scheduling problem with maintenance activities. Performance criteria considered are the maximum completion time so called makespan, the total workload of machines and the workload of the critical machine. Unlike the original ABC algorithm, the proposed DABC algorithm presents a unique solution representation where a food source is represented by two discrete vectors and tabu search (TS) is applied to each food source to generate neighboring food sources for the employed bees, onlooker bees, and scout bees. An efficient initialization scheme is introduced to construct the initial population with a certain level of quality and diversity. A self-adaptive strategy is adopted to enable the DABC algorithm with learning ability for producing neighboring solutions in different promising regions whereas an external Pareto archive set is designed to record the non-dominated solutions found so far. Furthermore, a novel decoding method is also presented to tackle maintenance activities in schedules generated. The proposed DABC algorithm is tested on a set of the well-known benchmark instances from the existing literature. Through a detailed analysis of experimental results, the highly effective and efficient performance of the proposed DABC algorithm is shown against the best performing algorithms from the literature.