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41.
Previous work has demonstrated that the low-Reynolds-number model of Launder and Sharma (1974) offers significant advantages over other two-equation turbulence models in the computation of highly non-universal buoyancy-influenced (or “mixed convection”) pipe flows. It is known, however, that the Launder and Sharma model does not possess high quantitative accuracy in regard to simpler forced convection flows. A variant of the low-Reynolds-number scheme is developed here by reference to data for constant property forced convection flows. The re-optimized model and the Launder and Sharma formulation are then examined against experimental measurements for mixed convection flows, including cases in which variable property effects are significant. 相似文献
42.
Yu-Qing Fang 《European Polymer Journal》2010,46(5):1163-1167
A series of polyimides (PIs) were copolymerized from 4-dodecyloxy-biphenyl-3′,5′-diaminobenzoate (DBPDA), 3,3′-dimethyl-4,4′-methylene-dianiline (DMMDA) and 4,4′-oxydi(phthalic anhydride) (ODPA) via one-step method. The PIs possessed excellent solubility in polar aprotic solvents and easily formed thin flexible films by solution casting. The glass-transition temperatures (Tgs) of the PIs were in the range of 219-242 °C and thermal decomposition temperatures in nitrogen occurred above 350 °C. The resultant PI films exhibited high transparency at wavelengths greater than 400 nm and induced excellent uniform vertical alignment of liquid crystal (LC). Even after the rubbing process, the pretilt angles of LC were still above 89°. The PI seems to be a prospective material for alignment layers in flexible displays. 相似文献
43.
S. Shahab Naghavi Thomas Gruhn Gerhard H. Fecher Katerina Medjanik Sergej A. Nepijko Ralph Rieger Klaus Müllen 《Journal of Molecular Spectroscopy》2011,265(2):95-1319
Functionalized polycyclic aromatic hydrocarbons (PAHs) are an interesting class of molecules in which the electronic state of the graphene-like hydrocarbon part is tuned by the functional group. Searching for new types of donor and acceptor molecules, a set of new PAHs has recently been investigated experimentally using ultraviolet photoelectron spectroscopy (UPS). In this work, the electronic structure of the PAHs is studied theoretically with the help of B3LYP hybrid density functionals. Using the ΔSCF method, electron binding energies have been determined which affirm, specify and complement the UPS data. Symmetry properties of molecular orbitals are analyzed for a categorization and an estimate of the related signal strength. While σ-like orbitals are difficult to detect in UPS spectra of condensed film, calculation provides a detailed insight into the hidden parts of the electronic structure of donor and acceptor molecules. In addition, a diffuse basis set (6-311++G**) was used to calculate electron affinity and LUMO eigenvalues. The calculated electron affinity (EA) provides a classification of the donor/acceptor properties of the studied molecules. Coronene-hexaone shows a high EA, comparable to TCNQ, which is a well-known classical acceptor. Calculated HOMO-LUMO gaps using the related eigenvalues have a good agreement with the experimental lowest excitation energies. TD-DFT also accurately predicts the measured optical gap. 相似文献
44.
We investigate theoretically the dynamics of three low-order transverse modes in a small-area vertical cavity surface emitting laser. We demonstrate the spontaneous breaking of axial symmetry of the transverse field distribution in such a device. In particular, we show that if the linewidth enhancement factor is sufficiently large dynamical regimes with broken axial symmetry can exist up to very high diffusion coefficients ~ 10 μm2/ns. 相似文献
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