Gold-surface binding of molecular switches studied by M?ssbauer spectroscopy

The nonanuclear coordination compound [Mo^IV{(CN)Fe^III(3-methyl-saldptn)}₈]Cl₄ exhibits multiple spin transitions (3-methyl-saldptn = N,N′-bis(3′′-methyl-2′′-hydroxy-benzyliden)-1,7-diamino-4-azaheptane). This spin crossover cluster is bound via a self-assembled monolayer onto a two dimensional array gold surface. M?ssbauer spectroscopy indicates that the thermally and optically induced spin crossover of the compound is maintained. Thereby, the foundation for its potential practical application (e.g. in the field of information storage) was laid.     

Pulsed electron-electron double resonance (PELDOR) distance measurements in detergent micelles

Pulsed electron-electron double resonance (PELDOR) spectroscopy is a powerful tool for measuring nanometer distances in spin-labeled systems. A common approach is doubly covalent spin-labeling of a macromolecule and measurement of the inter-spin distance, or to use singly-labeled components of a system that forms aggregates or oligomers. This situation has been described as a spin-cluster. The PELDOR signal, however, does not only contain the desired dipolar coupling between the spin-labels of the molecule or cluster under study. In samples of finite concentration the dipolar coupling between the spin-labels of the randomly distributed molecules or spin-clusters also contributes significantly. In homogeneous frozen solutions or lipid vesicle membranes this second contribution can be considered to be an exponential or stretched exponential decay, respectively. In this study, we show that this assumption is not valid in detergent micelles. Spin-labeled fatty acids that are randomly partitioned into different detergent micelles give rise to PELDOR time traces which clearly deviate from stretched exponential decays. The obtained signals can be modeled quantitatively based on the size of the micelles, their aggregation number, the spin-label concentration and the degree of spin-labeling. As a main conclusion a PELDOR signal deviating from a stretched exponential decay does not necessarily prove the observation of specific distance information on the molecule or cluster. These results are important for the interpretation of PELDOR experiments on membrane proteins or lipophilic peptides solubilized in detergent micelles or small vesicles, which often do not show pronounced dipolar oscillations in their time traces.     

Influences of substrate temperature on microstructure and corrosion behavior of APS Ni_(50)Ti_(25)Al_(25) inter-metallic coating

In the present investigation, Ni_(50)Ti_(25)Al_(25)(at.%) mechanically alloyed powder is deposited on carbon steel substrate.Before the coating process, the substrate is heated to temperature ranging from room temperature to 400℃. The microstructure, porosity, microhardness, adhesion strength, and corrosion behavior of the coating are investigated at different substrate temperatures. Results show that coating porosity is lower on high temperature surface. Microhardness and adhesion strength of the deposition layer on the substrate without preheating have lower values than with preheating. The polarization test result shows that corrosion performance of the coating is dependent on micro cracks and porosities and the increasing of substrate temperature can improve the quality of coating and corrosion performance.     

Dust acoustic solitary and shock waves in strongly coupled dusty plasmas with nonthermal ions

The Korteweg-de Vries-Burgers (KdV-Burgers) equation and modified Korteweg-de Vries-Burgers equation are derived in strongly coupled dusty plasmas containing nonthermal ions and Boltzmann distributed electrons. It is found that solitary waves and shock waves can be produced in this medium. The effects of important parameters such as ion nonthermal parameter, temperature, density and velocity on the properties of shock waves and solitary waves are discussed.     

Comparison between standard and counterpoise-corrected optimization using some hydrogen and halogen bonded systems

The effect of the counterpoise correction on the geometries, stabilization energies, and vibrational harmonic frequencies of some hydrogen- and halogen-bonded systems (B?=?CH₃CN,?HCN,?NH₃,?N₂,?CO,?H₂O,?H₂S,?PH₃;?HX?=?HF,?HCl,?HBr,?HCN,?HCF₃; XY?=?Br₂,?BrCl,?BrF,?Cl₂,?ClF,?F₂) has been analysed at the MP2 level of theory using the popular 6-311++G(d,p) basis set. The optimized B?···?H and B?···?X bond lengths increase with counterpoise (CP) correction. In some cases standard values and in other cases CP-corrected values are close to experimental data. The absolute values of complexation energies of CP-corrected structures are higher than standard by inclusion of BSSE correction. The effect of CP correction on intermolecular bond lengths and complexation energies of B?···?XY series are usually higher than B?···?HX. Also, this effect is higher for H₂S and PH₃ groups. The CP correction changes the vibrational harmonic frequencies by 0–100%. The changes are frequently lower than 20% for frequencies higher than 300?cm^?1.     

Formation of silver iodide nanoparticles on silk fiber by means of ultrasonic irradiation

The growth of silver iodide nanoparticles on silk fiber was achieved by sequential dipping in an alternating bath of potassium iodide and silver nitrate under ultrasound irradiation. Some parameters such as effect of pH, concentration and numerous sequential dipping in growth of the nanocrystal have been studied. The samples were characterized with powder X-ray diffraction (XRD), scanning electron microscopy (SEM), ICP, TGA and solid state UV–vis spectroscopy.     

Improved photonic crystal directional coupler with short length

We investigate a photonic crystal (PC) waveguide coupler which is formed by two closely spaced linear waveguides in a two-dimensional triangular lattice of air holes. Our study shows that shifting one row of the air holes between the waveguides affects the dispersion curves of the guided modes and if the triangular lattice of air holes between the waveguides is replaced by a rectangular lattice, this modification results in an ultra-short coupling structure with coupling length less than 3a, where a is the lattice constant. Also, we investigate the effect of changing the radii of air holes that are adjacent to or between the waveguides on the coupling length and show that increasing the radius of air holes between the waveguides decreases the coupling length. We analyze the output spectrum of an ultra-short channel drop filter designed based on this structure.     

Do we know the mass of a black hole? Mass of some cosmological black hole models

Using a cosmological black hole model proposed recently, we have calculated the quasi-local mass of a collapsing structure within a cosmological setting due to different definitions put forward in the last decades to see how similar or different they are. It has been shown that the mass within the horizon follows the familiar Brown–York behavior. It increases, however, outside the horizon again after a short decrease, in contrast to the Schwarzschild case. Further away, near the void, outside the collapsed region, and where the density reaches the background minimum, all the mass definitions roughly coincide. They differ, however, substantially far from it. Generically, we are faced with three different Brown–York mass maxima: near the horizon, around the void between the overdensity region and the background, and another at cosmological distances corresponding to the cosmological horizon. While the latter two maxima are always present, the horizon mass maxima is absent before the onset of the central singularity.     

Temperature tunable random laser using superconducting materials

We propose that spectral intensity of superconductor based random lasers can be made tunable by changing temperature. The two fluid model and wavelength dependent dispersion formula have been employed to describe the optical response of the superconducting materials. Random laser characteristics have been calculated using the one dimensional FDTD method. Our simulation results reveal that the emission spectrum can be manipulated through the ambient temperature of the system. It is observed that transition from metal phase to pure superconducting phase leads to the enhancement of the laser emission. Furthermore, spatial distribution of the fields in one dimensional disordered media is very sensitive to the system temperature.