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1.
2.
Prapti Saxena Sankar P. Sanyal 《Physica E: Low-dimensional Systems and Nanostructures》2004,24(3-4):244-248
We report a detailed study of the phonon properties of hexagonal boron nitride (BN) monolayers as well as nanotubes by using De Launay type of angular force model. The force constants used for calculation of phonon dispersion relations of the nanotube are derived from those for the monolayers of hexagonal by employing force constant method. These force constants have been modified to include the effect of curvature of the tubule. The results are then used to derive the phonon dispersion relations for (10,10) BN nanotubes using ‘zone-folding’ method. Calculated phonon modes are in good agreement with the experimental values obtained so far, for (10,10) armchair BN nanotubes. 相似文献
3.
Cyclic voltammetric studies of certain industrially potential iron chelate catalysts 总被引:1,自引:0,他引:1
For the analysis of infrared spectroscopic bands and complex patterns partial cross correlation functions of a sample spectrum
with reference spectra are calculated. The chosen ranges of the spectra are based on empirical knowledge of infrared spectrum
structure correlations. The normalised maxima of the partial cross correlation functions are interpreted as fuzzy truth values
and are combined by fuzzy logical operators. By application of that procedure larger common substructures will be derived
from the reference spectra than by a maximum common substructure search based on the complete spectra.
Received: 30 October 1996/Revised: 24 February 1997/Accepted: 26 February 1997 相似文献
4.
It has been found that the states of the 2-charge extremal D1–D5 system are given by smooth geometries that have no singularity and no horizon individually, but a ‘horizon’ does arise after ‘coarse-graining’. To see how this concept extends to the 3-charge extremal system, we construct a perturbation on the D1–D5 geometry that carries one unit of momentum charge P. The perturbation is found to be regular everywhere and normalizable, so we conclude that at least this state of the 3-charge system behaves like the 2-charge states. The solution is constructed by matching (to several orders) solutions in the inner and outer regions of the geometry. We conjecture the general form of ‘hair’ expected for the 3-charge system, and the nature of the interior of black holes in general. 相似文献
5.
A. Saxena D. Fabris G. Prete D. V. Shetty G. Viesti B. K. Nayak D. C. Biswas R. K. Choudhury S. S. Kapoor M. Lunardon S. Moretto G. Nebbia S. Pesente V. Rizzi A. M. Samant M. Barbui E. Fioretto M. Cinausero A. Brondi G. La Rana R. Moro E. Vardaci N. Gelli F. Lucarelli 《Nuclear Physics A》2004,730(3-4):299-315
Pre-scission and post-scission multiplicities of neutrons and alpha particles have been simultaneously measured for the fission-like reactions of 340 MeV 28Si on 232Th. Dynamical model calculations using HICOL code predict that about 90% of the observed events are of quasi-fission type while the remaining 10% are from compound nucleus fission decay. Moving source fits were carried out to the observed neutron and alpha particle spectra, measured at different angles with respect to the fragment directions. The pre-scission and post-scission neutron multiplicities are deduced to be 8.7±2.0 and 9.4±2.0, respectively. The corresponding multiplicity values for alpha particles are found to be 0.22±0.08 and 0.1±0.03. From the measured post-scission neutron multiplicity, it is inferred that about 65±20 MeV of the initial excitation energy remains at scission. This may be compared to the value of 85±30 MeV estimated from PACE2 statistical model calculations, adjusted to reproduce the measured pre-scission neutron multiplicity. From a comparison of the Statistical Model predictions with the measured pre-scission neutron multiplicity, the fission delay is estimated to be of 5+7−3×10−20 s which overlaps with the average duration of fission-like process from the contact to the scission point (2×10−20 s) as determined from HICOL-based dynamical calculations. For the delay time deduced as above, the pre-scission alpha particle multiplicity calculated by the PACE2 code is about a factor two larger than the experimental one, demonstrating the difficulties in modelling the alpha particle emission from highly elongated shapes that characterize the fissioning system from the contact point to scission. 相似文献
6.
Anubhav Saxena Roopali Rai Sun-Young Kim Michiya Fujiki Masanobu Naito Kento Okoshi Giseop Kwak 《Journal of polymer science. Part A, Polymer chemistry》2006,44(17):5060-5075
Noncovalent interactions, such as hydrogen bonding, metal coordination, and π-π stacking, are increasingly being utilized to develop well-ordered and self-organized supramolecular materials. Recently, new types of nonclassical weak interactions, such as C H···π, C H···F C, and C H···O, have been exploited in stabilizing the specific conformations of molecules and molecular assemblies in the solid state. These noncovalent interactions play an important role in materials comprised of polymer chains, because cooperative effects from a large number of weak interactions can lead to drastic changes in its conformation, several properties, and functionalities. The programmed design of synthetic helical polymer with well-defined molecular conformation has been the main subject in modern polymer science and engineering. Silicon-catenated polysilane is an ideal helical silicon quantum wire and polymers with unique photophysical properties. The present review highlights the spectroscopic evidences for through-space weak Si···F C interaction in poly(methyl-3,3,3-trifluoropropylsilane) ( 1 ) in noncoordinating and coordinating solvents by means of NMR (29Si and 19F) and IR spectroscopies, and viscometric measurement. It was found that 1 is applicable for chemosensors with an extremely high sensitivity and selectivity toward fluoride ions in tetrahydrofuran (THF) and with high sensitivity for nitroaromatic compounds, detected by a decrease in the photoluminescence intensity in THF and in thin solid film. © 2006 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 44: 5060–5075, 2006 相似文献
7.
8.
The syntheses of some 2-mercaptobenzimidazole (I) derivatives have been described. While preparing such compounds it has been observed that I reacts predominantly as the thione under anhydrous reaction conditions, and as the thiol in the presence of an alkali. Strutures of all of the nine compounds have been established with the help of spectral methods including 13C nmr spectroscopy of the two compounds (II and III). 相似文献
9.
Summary The kinetics of the RuIII-catalyzed oxidation of the hydroxy acids; lactic, tartaric, malic and citric acids byN-bromosuccinimide in HClO4 and in the presence of Hg(OAc)2 have been studied. The reactions exhibit a first order rate dependence with respect to the oxidant and zeroth order rate dependence with respect to substrate. The rate is retarded by [H+], accelerated at law RuIII concentrations but independent of [RuIII] at higher RuIII concentrations. A mechanism consistent with the observed kinetic data is proposed. 相似文献
10.
Akhilesh K. Verma Rupesh Kumar Amit Saxena Subho Mozumdar 《Tetrahedron letters》2005,46(31):5229-5232
A novel method for effecting the aza-Michael reactions of N-alkyl- and N-arylpiperazines with acrylonitrile using Cu-nanoparticles is described. The method features the use of 10 mol % Cu (14-17 nm) nanoparticles under mild reaction conditions to afford the addition products in good to excellent yields. The Cu-nanoparticles selectively catalysed the aza-Michael reaction of N-alkyl- and N-arylpiperazines in the presence of aromatic amino or aliphatic hydroxy groups. 相似文献