Composition and Antifungal Activity of Lipids from Seeds of Atriplex tatarica

Chemistry of Natural Compounds -     

Study of the Photocatalytic Antimicrobial Activity of Nanocomposites Based on TiO2–Al2O3 under Action of LED Radiation (405 nm) on Staphylococci

Optics and Spectroscopy - We study the photocatalytic activity of nanocomposites based on θ-phase alumina (Al2O3) with different TiO2 concentrations for heterogeneous photocatalysis and...     

On the Tender X-Ray Flat-Field Spectrograph with a Concave VLS Grating

Journal of Russian Laser Research - We analyze the way of advancing to tender X-rays the short-wavelength bound of the operating range of flat-field grating spectrographs. We design two VLS grating...     

Tandem silylation—desilylation reaction in the synthesis of N-methyl carboxamides

Russian Chemical Bulletin - The N-methylation of primary carboxamides is based on two consecutive reactions. The silylation of the corresponding carboxamides with chloro(chloromethyl)dimethylsilane...     

STRUCTURAL ISOMERS AND VIBRATIONAL SPECTRUM OF TETRAFLUOROSUBSTITUTED ZINC PHTHALOCYANINE

Journal of Structural Chemistry - Structural parameters and relative Gibbs free energies are calculated by density functional theory methods for four tetrafluoro derivatives of zinc(II)...     

CCSD(T) study on the structures and chemical bonds of AnO molecules (An = Bk–Lr)

The molecular geometries and dissociation energies of AnO (An = Bk–Lr) molecules were first obtained at thecoupled-cluster single-, double-, and perturbative triple-excitations [CCSD(T)] level of theory. Four hybrid functionals,B3LYP, M06-2X, TPSSh, and PBE0, were also employed in the calculations for the sake of comparison. In comparison ofthe CCSD(T) results, B3LYP, TPSSh, and PBE0 functionals can obtain more appropriate results than M06-2X and MP2.The analyses on molecular orbitals show that the 7s, 6d, and 5f atomic orbitals of actinide (An) atoms participate in thebonding of An–O bonds. The partial covalent nature between An and O atoms is revealed by QTAIM analyses.     

Electron Backscattered Diffraction for the Study of Matrices for Immobilization of Actinides Composed of the Murataite-Type Phases

Crystallography Reports - Electron backscattered diffraction (EBSD) has been used to analyze structures of natural minerals and artificial compounds for almost three decades. In recent years, it is...     

Boundary Conditions in the Source of an Electron Beam on the Surface of the Anode Plasma with a Supersonic Ion Flow

Russian Physics Journal - A solution for the one-dimensional Poisson problem for a layer on the surface of a plasma ion emitter is obtained. The case of plasma with a directed ion velocity greater...     

Optimal parameter selection for constraint-following control for mechanical systems based on Stackelberg game

Nonlinear Dynamics - This paper proposes an optimal parameter design of control scheme for mechanical systems by adopting the Stackelberg game theory. The goal of the control is to drive the...