Insulator-metal phase diagram of the optimally doped manganites from the disordered Holstein-double exchange model

We study the Holstein-double exchange model in three dimensions in the presence of substitutional disorder. Using a new Monte Carlo technique we establish the phase diagram of the clean model and then focus on the effect of varying electron-phonon coupling and disorder at fixed electron density. We demonstrate how extrinsic disorder controls the interplay of lattice polaron effects and spin fluctuations and leads to widely varying regimes in transport. Our results on the disorder dependence of the ferromagnetic T(C) and metal-insulator transitions bear direct comparison to data on the "optimally doped," x = 0.3-0.4, manganites. We highlight disorder induced polaron formation as a key effect in these materials, organize a wide variety of data into a simple "global phase diagram," and make several experimental predictions.     

Analytical modeling and ATLAS simulation for a homojunction LED in the mid-infrared spectral region

A generic analytical model and the ATLAS simulation of a homojunction light emitting diode（LED） based on p＋-InAs0.91Sb0.09/n0-InAs0.91Sb0.09/n＋-InAs0.91Sb0.09 materials grown on lattice matched p＋-GaSb substrate are presented.This LED is suitable for use as source in the optical absorption gas spectroscopy in the mid-infrared spectral region at 300 K.The various electro-optical properties of the homojunction LED are evaluated using analytical techniques and ATLAS device simulation software.The current-voltage characteristics of the structure are computed analytically and simulated,and the results are found to be in good agreement.The output power of the homojunction LED is estimated as a function of bias current under high carrier injection and compared with the reported experimental results.     

Rapid synthesis and biological evaluation of 1,4-dihydropyridine derivatives containing a benzothiazolyl moiety

A series of N-(6-methylbenzothiazolyl)-2,3,5,6-tetrasubstituted-4-(aryl)-1,4-dihydropyridines were synthesized by reaction of 2-amino-6-methylbenzothiazole, aromatic aldehyde and active methylene compound in methanol by conventional, as well as, microwave irradiation (solvent free and solid support) methods. The microwave irradiation technique gives better yield and shorter reaction time. Among solid supported microwave irradiation better yields are obtained in acidic alumina as compared to silica, neutral alumina, and basic alumina. All compounds were tested for antibacterial and antifungal activities and results have been compared with standard drugs. Entomological activities were also tested. The results showed that a change in the substitution pattern in 1,4-dihydropyridine derivatives may cause a marked effect on their antimicrobial activity.     

Consequence of doping mediated strain and the activation energy on the structural and optical properties of ZnO:Cr nanoparticles

We report on the sol-gel synthesis of Zn_1−xCr_xO (x=0.0, 0.05, 0.10, 0.15 and 0.20) nanoparticles. These nanoparticles were characterized by using thermogravimetry/differential scanning calorimetry (TG/DSC), X-ray diffraction (XRD), transmission electron microscopy (TEM), Raman and Photoluminescence (PL). Electronegativity of Cr ions (Cr³⁺) reduces the final decomposition temperature by 40 °C and activation energy of the reaction when Cr is doped into ZnO. Doping of higher Cr concentration (x≥0.10) into ZnO shows formation of secondary spinel (ZnCr₂O₄) phase along with the hexagonal (ZnO) and is revealed by XRD. Formation of secondary phase changes the activation energy of the reaction and thus the strain in ZnO lattice. In Raman spectra, additional Raman modes have been observed for Zn_1−xCr_xO nanoparticles, which can be assigned to the modes generated due to Cr doping. The Cr doping into ZnO is also supported by PL, in which vacancies are formed with Cr ion incorporation and emission band shifts towards higher wavelength.     

Interface identification by non-local autoionization transitions

We use an autoionization process that involves ultrafast energy transfer to neighbouring sites to characterize the formation of NeAr van der Waals bonds in clusters formed by a coexpansion of both gases. This autoionization process, the so-called interatomic or intermolecular coulombic decay (ICD), is ubiquitous in weakly bonded systems. The energy of the electron being emitted in the ICD process is shown to be characteristic of the two neighbouring entities and is therefore suggested as a new means for structural investigation, such as interface identification, of weakly bonded complexes.     

Stagnation point transient heat flux measurement analysis from coaxial thermocouples

The transient heat flux measurement at stagnation point is a significant solicitation at highly compressed flow field environment. In aerodynamics surface heating point of view, the estimation of stagnation heat fluxes at the tip of a blunt body is very imperative. When the blunt body is exposed to high-speed flow field environments, at the stagnation point heat transfer would be maximum. The coaxial surface junction thermocouples (CSJTs) are convenient for short duration time scale due to the fast response in the range of millisecond or less (?0.1 ms). These robust CSJTs have the tractability of intensifying them directly on any type of surface and can be used for routine measurement in ground-based impulse amenities as a temperature measuring devices where rapid heat loads are anticipated. In this work, three different types of coaxial thermocouples K-type, E-type, and J-type have been designed and contrived. The microstructural analysis of measuring surface property has been carried out to see the surface morphology using field emission scanning electron microscopy (FESME) and chemical characterization of these CSJTs materials using energy dispersive X-ray analysis (EDXA) technique is used to verify qualitatively appraise the CSJTs materials composition. The thermal coefficient of resistance (TCR) and sensitivity (S) of each coaxial thermocouple have been determined by using oil-bath calibration technique with the linear variation of resistance corresponding to the variation of temperature and found that these coaxial thermocouples are highly sensitive and suitable for highly transient heat transfer measurements. For this purpose, these three types of CSJTs have been tested under highly compressed heated air 310 K temperature for 100 ms at pressure 6.1 bar with Mach number unity (M = 1) using compressor test rig. Numerical simulation has also been carried out with these three RTDs to satisfy the experimental parameters using Ansys Fluent 15.0 and typical transient temperature recorded. Surface heat fluxes recovered from experimental and numerical transient temperatures histories using semi-infinite heat conduction modeling having good agreement with accuracy ±3% or less. This study divulges the expertise of these handmade coaxial thermocouples for transient surface heat flux measurement for short durations at highly compressed air facilities.     

系统单芯片在便携式医疗电子的应用

便携式医疗电子在近几年出现可观的成长,获业界广泛的采纳,市场许多新设立的企业持续推出新的衍生产品。目前需要的是更好的可量产设计,提供较低的复杂度与可接受的效能水平,让业者能压低装置的成本。     

A fast response thermocouple for internal combustion engine surface temperature measurements

A fast response thermocouple was developed for measuring surface temperatures of aluminum components in ICE combustion chambers. The key features of the design are the use of the aluminum substrate as one of the thermocouple metals and the use of a thick copper layer as the hot junction at the surface. The copper equalizes the hot junction temperature with the surrounding aluminum to correct for the differences in thermal properties between the two materials. FEA determined the optimum thickness of the copper layer to be between 100 and 125 μm. Under typical SI engine heat flux conditions, the thermocouple should be able to measure average surface temperatures within 0.19 °C and the magnitude of temperature swings within 6% of true values.Following the FEA, the optimized thermocouple was tested in a SI engine. Experimental results displayed the same trends as the FEA at measuring average temperatures and temperature swings, suggesting the thermocouple was performing as predicted.     

Synthesis,characterization, in vitro antimicrobial and cytotoxic evaluation of Co(II), Ni(II), Cu(II) and Zn(II) complexes derived from bidentate hydrazones

Co(II), Ni(II), Cu(II) and Zn(II) complexes have been synthesized from hydrazone ligands (HL¹–HL⁴) obtained by condensation reaction of 6-chlorothiochroman-4-one with benz hydrazide/nicotinic hydrazide/isonicotinic hydrazide/p-toluic hydrazide. The synthesized compounds (1–20) were characterized by physicochemical procedures, i.e. (FTIR, ¹H NMR, ¹³C NMR, mass, ESR, UV–Vis), TGA/DTA, powder XRD, elemental analysis (CHN), magnetic susceptibility and molar conductance measurements. The various data suggested bidentate nature (NO) of hydrazones, which coordinate with central metal ions via nitrogen of azomethine (–C=N–) group and deprotonated carbonyl oxygen in the enolized form, resulting in octahedral complexes. Low values of molar conductance suggested their non-electrolytic nature. Thermal decomposition pattern of complexes confirms the metal oxides as end product. In vitro antimicrobial activity of hydrazones and their metal complexes were evaluated against two gram-positive bacteria (Bacillus subtilis and Staphylococcus aureus); two gram-negative bacteria (Pseudomonas aeruginosa and Escherichia coli); and two fungal strains (Candida albicans and Aspergillus niger) by serial dilution method, and it was found that the metal complexes were highly active as compared to hydrazones. Among all the compounds, complexes 11, 13, 14 and 19 were found most efficient antimicrobial agent. The anticancer activity of (1–20) compounds was performed on human cancer cell lines A549 (lung), DU145 (prostate) and SW620 (colorectal) by MTT assay using paclitaxel as reference drug. The cytotoxicity results suggested compounds [Cu(L²)₂(H₂O)₂] 11 as most potent against A549, DU145 and SW620 cancer cell lines with IC₅₀ values of 3.46, 18.21 and 7.61 µM. Furthermore, compounds (9, 10, 11, 12) were also investigated on A549 cell line for their ROS generation and mitochondrial membrane potential loss and suggested that complex [Cu(L²)₂(H₂O)₂] 11 has highest ROS production and induction of apoptosis by mitochondrial depolarization in cancer cells.

Graphic abstract

The synthesized compounds (1–20) were screened for in vitro cytotoxicity against A549 (lung), DU145 (prostate), SW620 (colorectal) human cancer cell lines. Copper complex (11) was found to be the most active antitumor agent which enhance ROS production and MMP loss on A549 cells.