Zobrazeno 1 - 10
of 32
pro vyhledávání: '"Yu. I. Tarasov"'
Publikováno v:
Тонкие химические технологии, Vol 12, Iss 1, Pp 5-25 (2017)
Ultrafast laser spectral and electron diffraction methods complement each other and open up new possibilities in chemistry and physics to light up atomic and molecular motions involved in the primary processes governing structural transitions. Since
Externí odkaz:
https://doaj.org/article/7dac20e46efa4b5ab5bba225225c3205
Publikováno v:
Membranes and Membrane Technologies. 1:127-136
The main trends in modifying the structure of bilayer metal-ceramic membranes developed in Russia to fabricate next-generation multilayer metal–ceramic membranes (MMCM) with a wide range of pore sizes from 0.4 to 100 nm and a narrow pore size distr
Publikováno v:
Journal of Structural Chemistry. 59:512-519
The structure and internal rotation of the bromonitromethane molecule are studied using electron diffraction analysis and quantum chemical calculations. The electron diffraction data are analyzed within the models of a general intramolecular anharmon
Publikováno v:
Тонкие химические технологии, Vol 12, Iss 4, Pp 5-35 (2017)
Basic knowledge of mankind so far relates to the description of electrons and atoms in the material in a state of equilibrium, where the behavior changes slowly over time. The electron diffraction with a high temporal and space resolution has opened
Publikováno v:
Journal of Structural Chemistry. 58:498-507
The structure and internal rotation of the 2-methyl-2-nitropropane molecule is studied by electron diffraction and quantum chemical calculations with the use of microwave and vibrational spectroscopy data. The electron diffraction data are analyzed w
Publikováno v:
Тонкие химические технологии, Vol 12, Iss 2, Pp 5-33 (2017)
To understand the dynamic features of molecular systems with a complex landscape of potential energy surfaces, it is necessary to study them in the associated 4D space-time continuum. The introduction of time in the diffraction methods and the develo
Publikováno v:
Тонкие химические технологии, Vol 12, Iss 1, Pp 5-25 (2017)
Ultrafast laser spectral and electron diffraction methods complement each other and open up new possibilities in chemistry and physics to light up atomic and molecular motions involved in the primary processes governing structural transitions. Since
Autor:
B. K. Novosadov, A. I. Boltalin, D. M. Kovtun, Yu. I. Tarasov, Igor V. Kochikov, Z. G. Bazhanova
Publikováno v:
Journal of Structural Chemistry. 51:409-418
Quantum chemical calculations of the equilibrium structure, potential energy surface cross-sections along the nonrigid degrees of freedom of (CF3COOAg)2, (CHF2COOAg)2, (CH2FCOOAg)2, and (CH3COOAg)2 dimers and the corresponding monomers are presented.
Publikováno v:
Journal of Molecular Structure. 921:255-263
In this paper, the equilibrium structural parameters of the 2-nitropropane molecule and the barrier of internal rotation of the nitrogroup are determined from the gas electron diffraction data, with the use of quantum chemistry calculations and exper
Autor:
D. M. Kovtun, Igor V. Kochikov, A. I. Boltalin, B. K. Novosadov, Yu. I. Tarasov, Z. G. Bazhanova
Publikováno v:
Journal of Structural Chemistry. 49:810-817
The results of B3LYP quantum-chemical calculations of the equilibrium structures of [(CX3COOCu)2]3, [(CX3COOCu)2]2, and (CX3COOCu)2 oligomers (X = H, F) using the cc-pVTZ correlation-consistent basis for C, O, and F atoms and the Stuttgart 1997 RSC b