National Institute Of Materials Physics - Romania

We study the superconducting order parameter in the non-centrosymmetric compounds Li-2(Pd1-xPtx)(3)B (x = 0, 0.3, 0.7 and 1) by measuring magnetic penetration depth lambda(T). The low temperature lambda(T) shows a linear temperature dependence for x >= 0.3, but follows exponential-like behavior for lower Pt contents. These findings suggest that a spin-triplet state might gradually develop with increasing x due to the broken inversion symmetry. Published by Elsevier B.V.

Electronic states and their energies are calculated for a mixed-ligand Ir(III) compound, (5-chloro-8-hydroxyquinoline) bis(2-phenylpyridyl) iridium (called IrQ(ppy)(2)-5CI) using time-dependent density functional theory (TDDFT) calculations and are compared with the experimental result. A good agreement is obtained between the calculated and measured absorption spectra: The d-pi(Q)* molecular orbital transition gives the lowest-energy triplet state absorption band. Its energy is estimated as 1.84 eV (671 nm), which is close to the absorption band position of 1.86 eV (666 nm) observed for IrQ(ppy)(2)-5CI doped in 4,4'-NN'-dicarbazole-biphenyl (CBP) host and of 1.88 eV (660 nm) observed for IrQ(ppy)(2)-5CI doped in polystyrene (PS). The second triplet state absorption band is caused by d-pi(ppy) transition. Its position is calculated as 2.51 eV (494 nm). The dipole moment is estimated as 3.45 D, which is lower than the dipole moment of fac-Ir(ppy)(3). This is understood by a reduced charge transfer between Ir(III) and quinoline ligand. Copyright (C) 2008 John Wiley & Sons, Ltd.

Among the great number of sol-gel materials prepared, TiO2 holds one of the most important places due to its photocatalytic properties, both in the case of powders and coatings. Impurity doping is one of the typical approaches to extend the spectral response of a wide band gap semiconductor to visible light. This work has studied some un-doped and Pd-doped sol-gel TiO2 nanopowders, presenting various surface morphologies and structures. The obtained powders have been embedded in vitreous TiO2 matrices and the corresponding coatings have been prepared by dipping procedure, on glass substrates. The relationship between the synthesis conditions and the properties of titania narrosized materials, such as thermal stability, phase composition, crystallinity, morphology and size of particles, and the influence of dopant was investigated. The influence of Pd on TiO2 crystallization both for supported and unsupported materials was studied (lattice parameters, crystallite sizes, internal strains). The hydrophilic properties of the films were also connected with their structure, composition and surface morphology. The methods used for the characterization of the materials have been: simultaneous thermogravimetry and differential thermal analysis, powder X-ray diffraction, electron microscopy (TEM, SAED) and AFM.

Transparent colorless Ca1-xYbxF2+x (X = 0-0007-0.016) crystals were grown using the vertical Bridgman technique. In order to obtain efficient Yb3+-Yb2+ conversion in the as-grown crystals, a special procedure has been developed. Room temperature optical absorption spectra reveal the characteristic UV absorption bands of the Yb2+ ions in the as-grown crystals, with intensities more than 10 times higher than those reported by other authors using various conversion procedures. The influence of YbF3 content and of codoping with Pb2+ ions on the absorption and emission spectra has been studied. Room temperature emission bands in the near UV (not reported before) and in the visible spectral domain have been observed. The emission intensity depends on the dopant concentration. A comparison of our results with those obtained by other authors is also given. (c) 2007 Elsevier B.V. All rights reserved.

Recently, MgB2 was discovered to be a superconductor with a surprisingly high critical temperature of about 39 K and with significant potential for applications. This material is usually prepared from a mixture of Mg and B in sealed tubes with excess Mg. As-prepared samples usually are very porous and mechanically weak. High density superconducting samples of MgB2 undoped and doped with SiC and B4C were produced by Field Assisted Sintering Technique (FAST) (T-c = 38.5 K). Samples are relatively large of 1.9 cm in diameter, apparently uniform, and can be easily extracted from the die. Processing times are short for easily attainable and relatively low temperatures. The effects of FAST consolidation on crystalline morphology revealed by microtomography and Scanning Electron Microscopy (SEM) and bulk density were investigated. Most samples have bulk density above 90% of the theoretical one. Despite such high bulk density, microtomography in combination with SEM revealed that in the samples there are some regions of low and high density. High density regions are not the consequence of FAST processing and they were observed in the raw material.

Metallo- phtalocyanines were obtained in good yields by the solvothermal method, a new and original synthesis method, optimized in real laboratory conditions. The structures were characterized by elemental analysis, UV-VIS and IR spectroscopy. Some of the compounds (iron phthalocyanine) were assigned by Mossbauer spectroscopy.

As recently shown, HgBa2Can-1CunOy (n >= 6) cuprate superconductors have a critical temperature of about 100 K independent of n. This remarkable property can be explained by the very imbalanced distribution of carriers among the inequivalent CuO2 planes in the unit cell. We discovered that these materials also have a common vortex melting line that resembles the theoretical melting lines of magnetically coupled pancake vortices. We suggest that there are two types of pancake pairs situated in the superconducting CuO2 outer planes: those separated by the thin charge reservoir layer are strongly (Josephson) coupled, while those separated by the thick block of (n-2) CuO2 nonsuperconducting inner planes are weakly (magnetically) coupled, forming magnetically coupled pancake vortex molecules.

The N,N-dimethylbiguanide (HDMBG) complexes [Cu-2(HDMBG)(2)Cl-4] (1) and respectively [Cu(HDMBG)(2)]Cl-2 center dot 2H(2)O (2) exhibit in vitro antimicrobial activity. The complexes were characterised by IR, electronic as well as EPR spectra. The IR spectra of complexes show the pattern of N,N-dimethylbiguanide coordinated as chelate. The electronic and EPR data are in agreement with a square pyramidal stereochemistry for (1) and a square planar one for (2). The in vitro qualitative and quantitative antimicrobial activity assays showed that the complexes exhibited variable antimicrobial activity against Gram-negative strains (Escherichia coli, Klebsiella spp. and Enterobacter sp.) isolated from the hospital environment. The thermal analysis has evidenced the thermal intervals of stability and also the thermodynamic effects that accompany them. The thermal behaviour in nitrogen is complex according to TG and DTA curves including melting., dehydration as well as compounds decomposition.

Double perovskite Sr2FeMoO6 type compounds show special properties, such as magnetoresistance response at relatively small-applied fields and at rather high temperatures (ca. 400 K). Perovskite precursors were obtained unconventionally, in liquid phase, using oxalic acid as complexing agent, in the presence of ethylene glycol as polymerization agent. Ordering control concerning the magnetic properties is predictable to be strongly influenced by the synthesis route. The thermal stability of the precursors and the phase transitions of the oxide samples were analyzed by thermal analysis method, IR spectroscopy, Mossbauer spectroscopy, X-ray diffraction method and magnetic measurements. The experimental data for the perovskite compounds prepared by using oxalic acid as complexing agent revealed a double perovskite structure of analyzed samples, convenient magnetorezistive response (3.51 mu(B)/f.u), in good agreement with the Mossbauer spectra. Moreover, Mossbauer spectreoscopy allows the distinction between the ordered and the disordered phases of the perovskite structure and put in evidence the strong dependence of the structural and magnetic characteristics of the double perovskites on the synthesis route.

Angle-resolved X-ray photoelectron spectroscopy (ARXPS) analysis has been performed on GaAs (10 0) surfaces in different conditions as naturally oxidized, Ar+ ion sputtering (E = 1-5 keV) and chemical etching in H2SO4/H2O2/H2O(3: 1: 1). The most sensitive angle to the surface compositional changes was the take-off angle (TOA): 25 degrees. Native oxide phases on GaAs consist of a mixture of Ga2O3, As2O3 and As2O5. Ar+ ion sputtering procedure modifies the surface composition, in the altered layer where the concentration ratio C-Ga/C-As tends to 1.5-1.6. Wet chemical etching removes the oxide layer and the As-rich region from the surface. In the experiment combining chemical etching with Ar+ ion sputtering for cleaning purpose, the native oxides are removed from the surface and C-Ga/C-As tends to stoichiometry. The experiment on native oxide reconstruction after storage in high-vacuum conditions (P similar to 10(-8) Torr) provides evidence of the high reactivity of GaAs (10 0) surfaces. We have observed the presence of an As oxide (BE = 43 eV) within a concentration range of 2-3%. (C) 2007 Elsevier B.V. All rights reserved.