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D. N. Karimov E. A. Krivandina Z. I. Zhmurova B. P. Sobolev V. A. Bezhanov S. P. Chernov G. M. Shapochkin 《Crystallography Reports》2006,51(6):1009-1015
Crystalline materials that are transparent in the vacuum UV spectral region and currently used have been reviewed. Transmission of crystals of solid solutions with the fluorite structure Ca1?x R xF2+x (R = Sc, Y, La, Yb, Lu) in the UV and vacuum UV spectral regions has been investigated. It is shown that application of different methods of purification of fluorides from some impurities can significantly improve the optical quality of fluoride multicomponent crystals in the short-wavelength spectral region. 相似文献
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Basic principles of the generalized lattice model of multicomponent condensed systems are formulated. Short-range parts of interatomic interactions are taken into account by means of the geometric constraints method. Long-range parts of the interactions are taken into account in mean field approximation. The expression for Helmholtz free energy is obtained. A system of integral equations for the equilibrium distributions of components is derived. The asymptotic properties of its solutions are investigated. Moment expansion of interatomic interactions and localization of integral terms in free energy is obtained. A Ginzburg–Landau-like functional of free energy is derived. 相似文献
189.
O. I. Gyrdasova V. N. Krasil’nikov I. G. Grigorov G. V. Bazuev 《Russian Journal of Inorganic Chemistry》2006,51(6):949-955
The effect of ethylene glycol (EG) on the formation of whiskers and fibers of complex oxides with the general formula MCo2O4 upon the thermolysis of M1/3Co2/3C2O4 (M = Zn, Mn) oxalates has been studied. New compounds (solvates) are formed when powdered oxalates are heated with EG. In the solvates, EG molecules substitute for water molecules according to the reaction M1/3Co2/3C2O4 · 2H2O + HOCH2CH2OH = M1/3Co2/3C2O4(HOCH2CH2OH) + 2H2O. The solvates have been characterized using X-ray powder diffraction, microscopy, IR spectroscopy, thermogravimetry, and chemical analysis. The shape, structure, and particle size of the thermolysis products of EG-modified oxalates have been determined using scanning electron microscopy. 相似文献
190.
M. F. Bobrov G. V. Popova V. G. Tsirelson 《Russian Journal of Physical Chemistry A, Focus on Chemistry》2006,80(4):584-590
The restricted Hartree-Fock method was used to determine the cycle size effects on the geometric parameters of several inorganic templates, cyclophosphazenes PnNnX2n (X = H, F, Cl; n = 2, 3, 4). A topological analysis of local electronic properties at the electron density critical points of bonds allowed us to quantitatively characterize the chemical bond in cyclophosphazenes and its dependence on the cycle size and substituents at phosphorus. The calculated distributions of the electron density Laplacian and electron pair localization functions revealed the special features of the electronic structure of the nitrogen and phosphorus atoms. These results explain the nature of noncovalent interactions between the P atoms of one cyclophosphazene molecule and the N atoms of the other. 相似文献