The Structure and Electrophysical Properties of Multiwall Carbon Nanotubes Subjected to Argon Ion Bombardment

Physics of the Solid State - The morphology, structure, and electrophysical characteristics of multiwall carbon nanotubes (MWCNTs), as affected by defects induced by ion bombardment, are studied...     

Magnetoplastic Effect in Te-Doped GaAs Single Crystals

Crystallography Reports - The influence of a dc magnetic field on the motion of growth dislocations with a density of (0.7–7.0) × 104 cm–2 and the electron density in the range of...     

New estimates for Ritz vectors

The following estimate for the Rayleigh-Ritz method is proved:

Here is a bounded self-adjoint operator in a real Hilbert/euclidian space, one of its eigenpairs, a trial subspace for the Rayleigh-Ritz method, and a Ritz pair. This inequality makes it possible to analyze the fine structure of the error of the Rayleigh-Ritz method, in particular, it shows that if an eigenvector is close to the trial subspace with accuracy and a Ritz vector is an approximation to another eigenvector, with a different eigenvalue. Generalizations of the estimate to the cases of eigenspaces and invariant subspaces are suggested, and estimates of approximation of eigenspaces and invariant subspaces are proved.

     

Luminescence and energy transfer in poly(N-vinylcarbazole) blends doped by a highly anisometric Eu(III) complex

Highly fluorescent blends based on PVK (poly(N-vinylcarbazole)) doped by a new greatly anisometric Eu(III) mesogenic complex were described. The structure of the ligands in the complex was selected in such a way that its absorption maximum was close to the emission maximum of the polymer. The full-energy transfer conditions in the conjugated polymer–lanthanide complex blends were revealed. Improving luminescence efficiency of the blend occurs due to an increase in the threshold concentration of the emitting ions to prevent self-quenching phenomena. The resulting relative luminescence quantum yield of the blend increases more than twice in comparison with the individual complex. The optimized blends may be promising for application as red emitters for OLED, etc.     

Synthesis and structure of polycrystalline adducts of Co(II) azomethine complexes with redox-active 2,4,6,8-tetrakis-(<Emphasis Type="Italic">tert</Emphasis>-butyl)phenoxazin-1-one

The six-coordinate cobalt complexes, C₅₇H_63.50N_4.50O₄Co (IIa), C₆₀H₆₉N₅O₄Co (IIb), C5₈H₆₇N₃O₈Co (IIc), C₅₆H₆₁N₅O₁₀Co (IId), C₅₆H₆₃N₃O₆Co (IIe), C₅₈H₆₆N₄O₆Co (IIf), and C₅₈H₆₃N₇O₈Co (IIg), adducts of high-spin tetrahedral Co(II) bis(salicylaldiminates) (C₂₉H_24.50N_3.50O₂Co (Ia), C₃₂H₃₀N₄O₂Co (Ib), C₃₀H₂₈N₂O₆Co (Ic), C₂₈H₂₂N₄O₈Co (Id), C₂₈H₂₄N₂O₄Co (Ie), C₃₀H₂₇N₃O₄Co (If), and C₃₀H₂₄N₆O₆Co (Ig)) and redox-active 2,4,6,8-tetrakis(tert-butyl)phenoxazin-1-one (L), were synthesized and studied for structure and magnetic properties. Complexes IIa–IIg have octahedral structure (CIF files CCDC nos. 1403920 (IIf), 1403922 (IIg)) and exist in the ground low-spin state (ls-Co^III-SQ), which arises upon intramolecular single-electron redox process in the ligand–metal system. The presence of substituents of different nature in the azomethine ligands of IIa–IIg does not induce any significant changes in their magnetic properties.     

Electronic structure and optical properties of the HoCoSi and ErNiSi compounds

The electronic structure and the optical properties of the HoCoSi and ErNiSi compounds are studied. Spin-polarized band calculations are performed in the local electron density approximation corrected for the strong electron–electron interactions in the 4f shell of a rare-earth ion (LSDA + U method [11]). The optical constants are measured by ellipsometry in a wide wavelength range, and the frequency dependences of a number of spectral parameters are determined. The calculated densities of states are used to interpret the structural features of the interband optical conductivities of the intermetallic compounds.     

Effects of chain length on the rates of C-C bond dissociation in linear alkanes and polyethylene

Molecular dynamics modeling of C-C bond dissociation is performed for a series of linear alkanes and polyethylene macromolecules with the chain lengths ranging from one to a thousand constituent ethylene monomers (PE-1-PE-1000). The rate constants obtained in molecular dynamics calculations are compared with those determined using variational transition state theory with the same potential energy surface. The results of simulations demonstrate a significant accelerating effect of chain length on the rates of C-C bond scission. Per-bond rate constant values increase with the increasing chain length, up to an order of magnitude, in the sequence of linear alkanes from PE-1 (ethane) to PE-5 (decane); this dependence becomes saturated for longer chain lengths. Stiffening the potentials of bending and especially the torsional degrees of freedom diminishes the accelerating effect of chain length, while constraining the bond distances for all C-C bonds except the one undergoing dissociation has no effect. The results of the calculations are compared with existing experimental data on the dependences of the rates of thermal decomposition of linear alkanes on the alkane chain length.     

Structural changes on the surface of tungsten foils under uniaxial tension

A change in the surface morphology of recrystallized tungsten foil under the effect of uniaxial tension in ultrahigh vacuum is studied by low-energy electron diffraction and atomic force microscopy. It is found by using low-energy electron diffraction that on the foil surface consisting of separate blocks with dominant face (112), there is a turn in orientation of the structural blocks. The analysis of the topograms of different areas of the side surface of a broken sample, obtained by atomic force microscopy, enabled the association of changes in the atomic structure of the surface layers of foil with a change in its relief by mechanical action.     

An Ellipsometric Investigation of the Optical Properties of Ru<Subscript>2</Subscript>Ge<Subscript>3</Subscript> and Ru<Subscript>2</Subscript>Sn<Subscript>3</Subscript> Compounds

Ellipsometric investigations of the optical properties of Ru₂Ge₃ and Ru₂Sn₃ intermetallic compounds are carried out in the wavelength range from 0.22 to 15 μm. The nature of interband light absorption is analyzed based on a comparative analysis of the experimental and theoretical frequency dependences of an optical conductivity. The obtained results confirm the existence of energy gaps at the Fermi level in the electronic spectra of these materials predicted earlier by the band-structure calculations.     

The even–odd effect in the dependence of optical anisotropy on the number of protons in complexing agent ions of liquid-crystal coordination compounds of lanthanides

The values of optical anisotropy of two series of thermotropic nematic liquid crystalline complexes based on the ions Eu⁺³, Gd⁺³, Tb⁺³, and Dy⁺³ have been determined. Even–odd alternation of optical anisotropy with an increasing number of protons in ions of lanthanides has been observed. It is established that, in the considered series of lanthanidomesogens, optical anisotropy is more sensitive to changes in the ligand structure of complexes than to the variation of the complexing agent.