National Institute Of Materials Physics - Romania

We study the validity of Hund's first rule for the spin multiplicity in circular molecules-made of real or artificial atoms such as quantum dots-by considering a perturbative approach in the Coulomb interaction in the extended Hubbard model with both on-site and long-range interactions. In this approximation, we show that an anti-Hund rule always defines the ground state in a molecule with 4N atoms at half-filling. In all other cases (i.e., number of atoms not a multiple of four, or a 4N molecule away from half-filling) both the singlet and the triplet outcomes are possible, as determined primarily by the total number of electrons in the system. In some instances, the Hund rule is always obeyed and the triplet ground state is realized mathematically for any values of the on-site and long-range interactions, while for other filling situations the singlet is also possible but only if the long-range interactions exceed a certain threshold, relatively to the on-site interaction.

A series of novel N-benzoyl-N'-aryl thiourea derivatives (BTU) bearing different number of alkoxy groups in terminal positions of benzoyl unit and a perfluorooctyl group on the other side have been designed and prepared. Their liquid crystalline properties were investigated by a combination of three techniques: polarizing optical microscopy (POM), differential scanning calorimetry (DSC) and variable-temperature powder X-ray diffraction (XRD). Their thermal stability was studied by thermogravimetric analysis (TG). It was found that only the compounds which have only one alkoxy chain attached to benzoyl unit, 1a and 1b, show calamitic mesomorphic behavior, with smectic A and C phases being displayed. The type and stability of these mesophases are greatly influenced by the alkyl chain length as well as by the presence of perfluorooctyl group. The clearing and the mesophase ranges are significantly increased with the incorporation of perfluoroalkyl chains when compared to non-fluorinated analogues, with almost 40 degrees C. The attachment of additional alkoxy groups on the benzoyl moiety led to a significant decrease of the clearing points and suppression of the mesogenic character.

Magnetic nanoparticles embedded in the active layer of the Organic Light Emitting Diodes (OLEDs) significantly increases the electroluminescence and the charge transport without influencing the transparency of these devices. A brief comparison was done in order to identify which parameter influences these properties, by comparing the CoFe2O4 magnetic nanoparticles with CoFe2 metallic magnetic nanoparticles, the latter one being obtained by thermal reduction in hydrogen of cobalt ferrite nanoparticles. CoFe2 have shown a better efficiency of the metallic nanoparticles where probably the main advantage is the higher magnetization property instead of the coercive field. Concerning the charge transport across the OLEDs, these nanoparticles reduce the electron injection, acting as filling traps, which directly increases the electroluminescence and the current at the same voltage.

Morphology is a key element in the functionality of low dimensional structures including here electroactive polymers, especially when applications such as muscle like actuators are sought. The reason is that morphology in the context of a high specific surface object strongly influences specific parameters such as ionic diffusion, conductivity and consequently the actuation capability of the system. In the present work a new architecture for microtube-based actuating elements is presented. Free-standing fibrillar microtubes with diameter in the range of micrometers and with a core-shell polyaniline/gold structure are fabricated through a scalable approach. Aligned electrospun poly(methyl methacrylate) fibers are coated with gold and are further employed as microstructured electrodes for the electrochemical deposition of polyaniline. Further the poly(methyl methacrylate) core was dissolved, leading to a tubular structure. The polyaniline/gold microtubes show complex, rapid and reversible movement patterns, with great stability and consistency over repeated actuation cycles. Thus, when the potential is swept between -0.2 and 1 V at different rates, the microtubes move, this movement being associated with the morphological and structural characteristics of the deposited polyaniline layer, a mechanism based on the expansion/contraction and conformational changes of the polymer chains due to the insertion/expulsion of ions. The response time of these electroactive microstructures during one cycle is in the range of seconds, a consequence of their low dimensionality and specific structure. Moreover the actuation takes place in different electrolytes including simulated gastric fluid, which enables a wide range of applications. (C) 2017 Elsevier B.V. All rights reserved.

Some of the modern aspects of field emission based electron sources have been collated in a short and comprehensive review. The usually overlooked peculiar aspects in this research field have been particularly emphasized in order to increase the interest in further fundamental studies and technological applications. The vast material was roughly split in two main branches which occasionally overlap: the electron emission devices based on chemically homogeneous nanostructured surfaces and the more complex nanocomposite emitting surfaces.

Fabrication methods are important way to improve structural and superconducting properties of MgB2 such as critical current, magnetic levitation force (MLF) and magnetic field trapping capability. Although the graded fabrication technique has been used for single-grain bulk YBCO superconductor to improve critical current and bulk superconducting properties, similar technique as regional doping has not been used for bulk MgB2, until now. In this study, nanoparticle silver doping was carried out in to the bulk MgTi0.06B2 superconductor by using in-situ solid state reaction and partial graded (regional) doping method together, to improve the radius independent uniform bulk current density and the magnetic levitation force as well as the structural properties of the MgB2 bulk superconductors. Both the J(c)(0) self-field critical current and F-p (mu H-0) pinning force density values enhanced in comparison with the inner region values, when the nanoparticle Ag doping is carried out in to the outer section of the sample. Addition to the enhancement of the structural and the micro electromagnetic properties as J(c)(0) and Fp (mu H-0), our study also focused on the improved of the bulk Jc and the radius of shielding current loop r, to improve bulk electromagnetic properties as the levitation force. It is seen that the structural properties enhanced and both the vertical levitation force and the lateral guidance force value increased with Ag doping to the outer section of MgTi0.06B2 sample. On the other hand, the increasing ratio of the lateral guidance force of 19.7% and the vertical levitation force of 10.8% of the sample with 3 wt% Ag-doped than the undoped one points out that the regional doping method to the outer section is very suitable for guidance force applications, which is important in the magnetic bearing application such as Maglev and magnetic energy storage systems. (C) 2017 Elsevier B.V. All rights reserved.

We combine low energy muon spin rotation (LE-mu SR) and soft-x-ray angle-resolved photoemission spectroscopy (SX-ARPES) to study the magnetic and electronic properties of magnetically doped topological insulators, (Bi, Sb)(2)Te-3. We find that one achieves a full magnetic volume fraction in samples of (V/Cr)(x)(Bi, Sb)(2-x)Te-3 at doping levels x greater than or similar to 0.16. The observed magnetic transition is not sharp in temperature indicating a gradual magnetic ordering. We find that the evolution of magnetic ordering is consistent with formation of ferromagnetic islands which increase in number and/or volume with decreasing temperature. Resonant ARPES at the V L-3 edge reveals a nondispersing impurity band close to the Fermi level as well as V weight integrated into the host band structure. Calculations within the coherent potential approximation of the V contribution to the spectral function confirm that this impurity band is caused by V in substitutional sites. The implications of our results on the observation of the quantum anomalous Hall effect at mK temperatures are discussed.

The development of soft actuators by using inexpensive raw materials and straightforward fabrication techniques, aiming at creating and developing muscle like micromanipulators, represents an important challenge nowadays. Providing such devices with biomimetic qualities, for example, sensing different external stimuli, adds even more complexity to the task. We developed electroactive polymer coated microribbons that undergo conformational changes in response to external physical and chemical parameters. These were prepared following three simple steps. During the first step nylon-6/6 microribbons were fabricated by electrospinning. In a second step the microribbons were one side coated with a metallic layer. Finally, a conducting layer of polypyrrole was added by means of electrochemical deposition. Strips of polypyrrole-coated aligned microribbon meshes were tested as actuators responding to current, pH, and temperature. The electrochemical activity of the microstructured actuators was investigated by recording cyclic voltammograms. Chronopontentiograms for specific current, pH, and temperature values were obtained in electrolytes with different compositions. It was shown that, upon variation of the external stimulus, the actuator undergoes conformational changes due to the reduction processes of the polypyrrole layer. The ability of the actuator to hold and release thin wires, and to collect polystyrene microspheres from the bottom of the electrochemical cell, was also investigated.

The exhaust of power and particles is regarded as a major challenge in view of the design of a magnetic confinement nuclear fusion demonstration power plant (DEMO). In such a reactor, highly loaded plasma facing components (PFCs), like the divertor targets, have to withstand both severe heat flux loads and considerable neutron irradiation. Existing divertor target designs make use of monolithic tungsten (W) and copper (Cu) material grades that are combined in a PFC. Such an approach, however, bears engineering difficulties as W and Cu are materials with inherently different thermomechanical properties and their optimum operating temperature windows do not overlap. Against this background, W Cu composite materials are promising candidates regarding the application to the heat sink of highly loaded PFCs. The present contribution summarises recent results regarding the manufacturing and characterisation of such W Cu composite materials produced by means of liquid Cu melt infiltration of open porous W preforms. On the one hand, this includes composites manufactured by infiltrating powder metallurgically produced W skeletons. On the other hand, W Cu composites based on textile technologically produced fibrous reinforcement preforms are discussed. (C) 2017 The Author(s). Published by Elsevier B.V.

For DEMO fusion reactor an expected heat flux of about 10MW/m(2) should be extracted by the divertor which will have, most likely, an armour part made of W and a following heat sink part made of Cu, or ODS Cu alloy. Unfortunately, for these materials the optimum operating temperature windows do not overlap. Thermal barrier materials are interface materials included in such components, aiming to keep the temperatures of both armour and heat sink parts in the corresponding operating windows, and to mitigate the effects of their different thermomechanical properties. Here we propose a simple spark plasma sintering route to create Cu-based composites with a high content (10-40 vol%) of various dispersed materials (Al or Y oxides, C, SiC), allowing a fine tuning of the content and a large pool of predefined shapes and dimensions. The resulting specimens can be further joined to armour and heatsink components via a similar electrical field assisted technology. Micro-structural and thermal properties are investigated for these materials allowing to select the most suited materials in view of their thermal conductivity and thermal expansion coefficients. (C) 2017 The Authors. Published by Elsevier B.V.