Thermodynamic properties of ternary systems: Calculation of standard enthalpies of solvation of triols, diols, and a series of their ethers in water-methanol mixed solvent

An equation for the standard enthalpy of solvation of a compound in a binary solvent is derived. The enthalpies of solvation in water-methanol mixtures are estimated for 1,3-propane-and 1,6-hexanediols, 1,2,4-butane-and 1,3,5-pentanetriols, 2-methoxy-and 2-propoxyethanols, and diethylene glycol. The enthalpy of solvation of 1,2-dimethoxyethane in the water-methanol mixed solvent is determined experimentally.     

Use of random numbers in computer simulation of magnetic resonance signals

The proton magnetic resonance spectra of water molecules diffusing over regular sites in natrolite are numerically simulated. Experimental data and the results of simulation are found to be in good agreement in a wide temperature interval including the transition range, where the magnetic resonance spectrum is a superposition of a wide unaveraged spectrum and a spectrum averaged by the motion of molecules. The simulation uses generators of pseudorandom-number Markovian sequences. For a binary Markovian process, it is shown, in particular, that the time within which a physical quantity remains constant is described by an exponentially distributed random number.     

Influence of the counterion size on swelling and collapse of polyelectrolyte gel

A theory that predicts the effect of the counterion size on the swelling and collapse of a weakly charged polyelectrolyte gel was developed. In addition to excluded-volume interactions between monomer units of the gel, the theory involves the counterion-monomer unit and counterion-counterion interactions in terms of the virial approximation. The character of interactions between different units in the system varies from repulsion to attraction depending on the type of solvent, counterion, and dielectric permittivity of the solvent. For solvents with a low permittivity, the effect of condensation of counterions resulting in the formation of ion pairs is taken into account.     

Magnetic ordering of YBa2(Cu1−x Fe x )3O7

The Mössbauer spectra of YBa₂(Cu_1?x Fe _x )₃O₇ at room temperature show several doublets attributed to Fe in Cu(1) sites with different oxygen configurations. Here we present a systematic study performed at 4.2 K forx=0.005, 0.01, 0.03, 0.05, 0.10, 0.15. To obtain information about the magnetic ordered state two samples, withx=0.005 andx=0.15, have been studied at 4.2 K underB _ext=5 T. The Mössbauer spectra indicate that the iron moments are polarized forx=0.005, while in the ordered state (x=0.15) they have an antiferromagnetic or spin-glass-like arrangement with high anisotropy.     

The Pontryagin Maximum Principle 50 years later

Proceedings of the Steklov Institute of Mathematics -     

Charge asymmetry in charmed-meson photoproduction

Within the perturbative-recombination model, the charge asymmetries in the D* ⁺–D* ^?, D* ⁰–D* ⁰, and D ⁺ _s –D ^? _s yields are estimated under the kinematical conditions of the COMPASS experiment. Corrections that arise owing to the mass of a light quark in a charmed meson are taken into account. The yield of D ⁺ _s meaons is predicted to be large in relation to the yield of D ^? _s mesons.     

Coagulation in lipid- and protein-containing systems

The behavior of real disperse systems with organic impurities was examined under conditions of destabilization by inorganic coagulants. A number of physicochemical methods of analysis and a simulation method were used to identify the character and type of the complexes formed and to calculate their stability constants.