Low-temperature IR and NMR studies of the interaction of group 8 metal dihydrides with alcohols

The reactions of the octahedral dihydrido complexes [MH(2)(PP(3))] [M=Fe, Ru, Os; PP(3)=P(CH(2)CH(2)PPh(2))(3)] with a variety of weak ROH acids have been studied by IR and NMR methods in either CH(2)Cl(2) or THF in the temperature range from 190 to 290 K. This study has allowed the determination of the spectral and thermodynamic properties associated with the formation of dihydrogen bonds (DHB) between the terminal hydrides and the OH group. Both the DHB enthalpy values and the hydride basicity factors (E(j)) have been found to increase in the order Fe < Ru < Os. The proton transfer process, leading to the DHB complexes, and eventually to eta(2)-H(2) products, has been found to depend on the acidic strength of the alcohol as well as the nature of the solvent. Low temperature IR and NMR techniques have been used to trace the complete energy profile of the proton transfer process involving the osmium complex [OsH(2)(PP(3))] with trifluoroethanol.     

On the NMR spectrum in antiferromagnetic CsMnI3

An explanation is proposed for the spin-reduction anisotropy observed in an investigation of NMR in the noncollinear six-sublattice antiferromagnet CsMnI₃. Pis’ma Zh. éksp. Teor. Fiz. 69, No. 1, 41–45 (10 January 1999)     

Characterization of single-crystal sapphire substrates by X-ray methods and atomic force microscopy

The possibility of characterizing a number of practically important parameters of sapphire substrates by X-ray methods is substantiated. These parameters include wafer bending, traces of an incompletely removed damaged layer that formed as a result of mechanical treatment (scratches and marks), surface roughness, damaged layer thickness, and the specific features of the substrate real structure. The features of the real structure of single-crystal sapphire substrates were investigated by nondestructive methods of double-crystal X-ray diffraction and plane-wave X-ray topography. The surface relief of the substrates was investigated by atomic force microscopy and X-ray scattering. The use of supplementing analytical methods yields the most complete information about the structural inhomogeneities and state of crystal surface, which is extremely important for optimizing the technology of substrate preparation for epitaxy.     

On the Diffuse Structure of the Toluene–Water Interface

The electric density profile along the normal to the phase interface between aromatic hydrocarbon toluene and water has been studied by X-ray reflectometry using synchrotron radiation. According to the experimental data, the width of the interface under normal conditions is (3.9 ± 0.1) Å. This value is much larger than a theoretical value of (5.7 ± 0.2) Å predicted by the theory of capillary waves with an interphase tension of (36.0 ± 0.1) mN/m. The observed broadening of the interface is attributed to its own diffuse near-surface structure with a width no less than Å, which is about the value previously discussed for (high-molecular-weight saturated hydrocarbon–water) and (1,2-dichloroethane–water) interfaces.     

Separable subspaces of affine function spaces on convex compact sets

Let K be a compact convex subset of a separated locally convex space (over R) and let Ap(K) denote the space of all continuous real-valued affine mappings defined on K, endowed with the topology of pointwise convergence on the extreme points of K. In this paper we shall examine some topological properties of Ap(K). For example, we shall consider when Ap(K) is monolithic and when separable compact subsets of Ap(K) are metrizable.     

Mass spectrometry of molecules and radicals in glow discharge plasma

The article represents a method and equipment developed for mass spectrometric analysis of plasma, that is, for measurement of concentration of atoms and molecules, and their fragments, including free radicals. A compact and inexpensive mass spectrometer is based on a quadrupole residual gas analyzer (RGA-200, Stanford Research Systems). The design of the two-section differential pumping chamber makes it possible to bring the mass-spectrometer analyzer to the entrance diaphragm to a distance of 40 mm in order to measure quick reacting and easily condensed particles. The equipment was used for analyzing the composition of spherical glow discharge plasma in methanol vapor and acetone-nitrogen mixture. A procedure for mass spectrum processing is proposed. Time-varying concentrations of all observed neutral particles are measured. Presently available data on sections of complete and dissociative ionization of molecules and their fragments, which are necessary for reconstructing concentrations of particles in plasma from measured mass spectra, are presented.     

On the Gomory–Hu Inequality

It was proved by R. Gomory and T. Hu in 1961 that, for every finite nonempty ultrametric space (X, d), the inequaliy \( \left| {\mathrm{Sp}(X)} \right|\leq \left| X \right|-1 \), where Sp(X) = {d(x, y) : x, y ∈ X, x ≠ y} , holds. We characterize the spaces X for which the equality is attained by the structural properties of some graphs and show that the set of isometric types of such X is dense in the Gromov–Hausdorff space of the isometric types of compact ultrametric spaces.     

Photoelectron spectra and electronic structure of boron difluoride β-diketonates with aromatic substituents

The electronic structure of boron difluoride chelate complexes of the acetyl acetonate type containing 4-biphenylene, 2-fluorene and 4-trans-stilbene as β-substituents is studied by means of photoelectron spectroscopy and quantum chemistry in the DFT approximation. It is established that the substituents affect the nature and sequence of the spectral bands. It is shown that calculation results corrected to the value of the Koopmans defect reproduce quite well the energy intervals between ionized states of complexes.