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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Aver'yanov E. M.
Заглавие : Anisotropy of the Local Field in Anisotropic Films of Conjugated Polymers
Место публикации : Phys. Solid State: MAIK NAUKA/INTERPERIODICA/SPRINGER, 2011. - Vol. 53, Is. 9. - P1933-1942. - ISSN 1063-7834, DOI 10.1134/S1063783411090046
Примечания : Cited References: 51
Предметные рубрики: MOLECULAR-WEIGHT DEPENDENCE
OPTICAL-PROPERTIES
THIN-FILMS
MEH-PPV
POLY(P-PHENYLENE VINYLENE)
CHAIN ORIENTATION
REFRACTIVE-INDEX
CONSTANTS
POLYACETYLENE
LIGHT
Аннотация: Using the data on dispersion of refractive indices in the visible region, the experimental values of the components L-j of the Lorentz tensor have been obtained for uniaxial (crystalline, oriented on a substrate, and stretched) films of conjugated polymers from nanometer to micrometer thicknesses. The dependence of the components L-j on the axial and planar orientations of macromolecules with respect to the optical axis of the film, technology of fabricating the films, and chemical structure of macromolecules has been elucidated. The correlation between the components L-j and the measured parameter. has been determined and the analytical dependence L-j(eta) for films with both types of macromolecular orientation has been established. In the visible region (0
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Averyanov E. M.
Заглавие : Character of the N-D-D-h(0,d) phase transition in diskotic liquid crystals
Место публикации : JETP Letters. - 1996. - Vol. 63, Is. 1. - P.33-37. - ISSN 0021-3640, DOI 10.1134/1.566959
Примечания : Cited References: 20
Предметные рубрики: MOLECULES
CONSTANTS
SPLAY
BEND
Аннотация: The first experimental data on the orientational ordering of a diskotic reentrant nematic N-D are presented. The data show that the phase transition N-D-D-h(0,D-d) is a strong first-order transition with a large jump Delta S similar or equal to 0.2 in the orientational order parameter S of the molecules. This indicates an anomalously strong coupling between the columnar and orientational ordering of the molecules and explains the absence of fluctuational divergence of the elastic moduli K-11 and K-22 in the nematic phase near this transition. (C) 1996 American Institute of Physics.
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Вид документа : Статья из журнала
Шифр издания :
Автор(ы) : Sorokin P.B., Kvashnin D.G., Kvashnin A.G., Avramov P. V., Chernozatonskii L.A.
Заглавие : Theoretical study of elastic properties of SiC nanowires of different shapes
Место публикации : J. Nanosci. Nanotechnol. - 2010. - Vol. 10, Is. 8. - P.4992-4997. - ISSN 1533-4880, DOI 10.1166/jnn.2010.2424. - ISSN 1533-4899
Примечания : Cited Reference Count: 49. - Гранты: This work was partially supported by JSPS-RFBR collaborative grant 09-02-92107. The electronic structure calculations have been performed on the Joint Supercomputer Centre of the Russian Academy of Sciences. One of the authors (Pavel V. Avramov) acknowledges the encouragement of Professor K. Morokuma, research leader of Fukui Institute, Kyoto University and Dr. Alister Page for kind help and support. The geometry of all structures was visualized by ChemCraft software.SUP53/SUPФинансирующая организация: JSPS-RFBR [09-02-92107]; Fukui Institute, Kyoto University
Предметные рубрики: INITIO MOLECULAR-DYNAMICS
SILICON-CARBIDE
THERMAL-STABILITY
CARBON NANOTUBES
NANORODS
GROWTH
SURFACES
NANOCRYSTALS
POTENTIALS
CONSTANTS
Ключевые слова (''Своб.индексиров.''): silicon carbide--nanowires--elastic properties--dft--molecular mechanics--dft--elastic properties--molecular mechanics--nanowires--silicon carbide--atomic structure--cubic phasis--dft--effective size--elastic properties--sic nanowire--silicon carbide nanowires--theoretical study--wire geometries--young's modulus--crystal atomic structure--density functional theory--elastic moduli--elasticity--molecular mechanics--nanowires--wire--silicon carbide
Аннотация: The atomic structure and elastic properties of silicon carbide nanowires of different shapes and effective sizes were studied using density functional theory and classical molecular mechanics. Upon surface relaxation, surface reconstruction led to the splitting of the wire geometry, forming both hexagonal (surface) and cubic phases (bulk). The behavior of the pristine SiC wires under compression and stretching was studied and Young's moduli were obtained. For Y-shaped SiC nanowires the effective Young's moduli and behavior in inelastic regime were elucidated.
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