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91.
We consider polymer structures which are known in the mathematical literature as "cospectral." Their graphs have (in spite of the different architectures) exactly the same Laplacian spectra. Now, these spectra determine in Gaussian (Rouse-type) approaches many static as well as dynamical polymer characteristics. Hence, in such approaches for cospectral graphs many mesoscopic quantities are predicted to be indistinguishable. Here we show that the introduction of semiflexibility into the generalized Gaussian structure scheme leads to different spectra and hence to distinct macroscopic patterns. Moreover, particular semiflexible situations allow us to distinguish well between cospectral structures. We confirm our theoretical results through Monte Carlo simulations. 相似文献
92.
Maxim E. Zhidkov Olga V. Baranova Natalya S. Kravchenko Sergey V. Dubovitskii 《Tetrahedron letters》2010,51(50):6498-6499
A new method for the synthesis of the marine alkaloid fascaplysin has been developed via a simple and practical approach to pyrido[1,2-a:3,4-b′]diindole ring system formation. Conversion of the marine alkaloid homofascaplysin C into fascaplysin is also described. 相似文献
93.
We study the molecular mechanisms of alkali halide ion interactions with the single‐wall carbon nanotube surface in water by means of fully atomistic molecular dynamics simulations. We focus on the basic physical‐chemical principles of ion–nanotube interactions in aqueous solutions and discuss them in light of recent experimental findings on selective ion effects on carbon nanotubes. 相似文献
94.
95.
DNA melting under torsion plays an important role in a wide variety of cellular processes. In the present Letter, we have investigated DNA melting at the single-molecule level using an angular optical trap. By directly measuring force, extension, torque, and angle of DNA, we determined the structural and elastic parameters of torsionally melted DNA. Our data reveal that under moderate forces, the melted DNA assumes a left-handed structure as opposed to an open bubble conformation and is highly torsionally compliant. We have also discovered that at low forces melted DNA properties are highly dependent on DNA sequence. These results provide a more comprehensive picture of the global DNA force-torque phase diagram. 相似文献
96.
Yurii A. Serguchev Maxim V. Ponomarenko Lyudmila F. Lourie Andrey A. Fokin 《Journal of Physical Organic Chemistry》2011,24(5):407-413
The addition of 1‐chloromethyl‐4‐fluoro‐1,4‐diazoniabicyclo[2.2.2]octane bis‐tetrafluoroborate (F‐TEDA) to unsaturated systems was modelled computationally at the ab initio levels and studied experimentally. The reaction of olefins with F‐TEDA is driven exclusively by charge transfer and displays the antibonding orbital picture in the transition structure for F‐transfer, similarly to that for the reactions of olefins with F‐radical. In contrast, the electrophilic and concerted fluorinations, respectively with H2O???F+ complex and with F2, show strong bonding interactions between the fluorine and olefin moieties in the transition structures. The reaction with F‐TEDA involves an initial formation of highly delocalized charge‐transfer complexes in the first step with further low‐barrier (ca 4 kcal) migration of fluorine and is best described as an inner‐sphere electron transfer. This nonelectrophilic mechanism is operative for the transannular addition of F‐TEDA to 3‐methylene‐7‐ethylidenebicyclo[3.3.1]nonane studied experimentally. The addition mode is determined by the formation of a more stable complex via the ethylidene fragment and demonstrates selectivities that differ from conventional electrophilic additions. This mechanistic scenario may be extended to the fluorination with xenon difluoride where similar products are formed in high yields. Copyright © 2010 John Wiley & Sons, Ltd. 相似文献
97.
Excepted for the very short terms the frequency stability of ultra-stable oscillators is mainly limited by the resonator noise. In this work we proposed a parametric model of the bulk acoustic wave (BAW) resonator phase noise based on an equivalent circuit. This model explains phase noise generated by a BAW crystal from a point of view of parametric fluctuations and proves the f−1 dependences of the crystal noise. The model performance is verified with simulation. Simulation results are compared to experimental data and discussed. Comparison of three existing models is made. 相似文献
98.
Using mutually modulated cross-gain modulation, Stokes optical frequency changes are converted into modulation phase changes with high sensitivity. In the slow-light transition regime, we demonstrate kilohertz sensitivity to the Stokes optical carrier frequency. The sensitivity is inversely proportional to the modulation frequency of the pump and Stokes beams. 相似文献
99.
Heterodyne near-field scanning optical microscopy (H-NSOM) has proven useful as a tool for characterization of both amplitude and phase of on-chip photonic devices in air, but it has previously been unable to characterize devices with a dielectric overcladding, which is commonly used in practice for such devices. Here we demonstrate H-NSOM of a silicon waveguide with a liquid cladding emulating the solid dielectric. This technique allows characterization of practical devices with realistic refractive index profiles. Fourier analysis is used to estimate the effective refractive index of the mode from the measured data, showing an index shift of 0.08 from air to water cladding, which is seen to correspond well to simulations. 相似文献
100.