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61.
Background
Organic light emitting devices (OLED) are becoming important and characterisation of them, in terms of structure, charge distribution, and intermolecular interactions, is important. Tris(8-hydroxyquinolinato)-aluminium(III), known as Alq3, an organomettalic complex has become a reference material of great importance in OLED. It is important to elucidate the structural details of Alq3 in its various isomeric and solvated forms. Solid-state nuclear magnetic resonance (NMR) is a useful tool for this which can also complement the information obtained with X-ray diffraction studies. 相似文献62.
Siripon Anantawaraskul Punnawit Somnukguandee Joo B. P. Soares Jumras Limtrakul 《Journal of Polymer Science.Polymer Physics》2009,47(9):866-876
Crystallization analysis fractionation (Crystaf) is a polymer characterization technique used to estimate chemical composition distributions (CCDs) of semicrystalline copolymers. The Crystaf profile can be transformed into a CCD using a calibration curve that relates average comonomer content to peak crystallization temperature. The calibration curve depends on copolymer molecular properties and Crystaf operation conditions. In this investigation, we applied a crystallization kinetics model to simulate Crystaf calibration curves and to quantify how Crystaf calibration curves depend on these factors. We applied the model to estimate the CCDs of three ethylene/1‐hexene copolymers from Crystaf profiles measured at different cooling rates and showed that our predictions agree well with the CCDs described by Stockmayer's distribution. We have also used this new methodology to investigate the effects of cooling rate, molecular weight, and comonomer type on Crystaf profiles and calibration curves. © 2009 Wiley Periodicals, Inc. J Polym Sci Part B: Polym Phys 47: 866–876, 2009 相似文献
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J. Nieto T. Oswald F. Blanco Joao B. P. Soares Benjamin Monrabal 《Journal of Polymer Science.Polymer Physics》2001,39(14):1616-1628
The effect of molecular weight and long‐chain branching on the crystallization analysis fractionation (CRYSTAF) of ethylene homopolymers was investigated. Several ethylene homopolymers were prepared with different molecular weights and levels of long‐chain branching to isolate these effects from the dominant effect of comonomer content on crystallizability measured by CRYSTAF. Molecular weight effects might be significant for samples with number‐average molecular weights below 5000, but this effect can be corrected if terminal methyl groups are taken into account. Long‐chain branching has only a very small effect on the CRYSTAF profile of the samples investigated in this study. © 2001 John Wiley & Sons, Inc. J Polym Sci Part B: Polym Phys 39: 1616–1628, 2001 相似文献
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67.
N. Papamichael Maria Joana Soares 《Numerical Methods for Partial Differential Equations》1991,7(1):43-59
An O(h6) method for the interpolation of harmonic functions in rectangular domains is described and analyzed, The method is based on an earlier cubic spline technique [N. Papamichael and J.R. Whiteman, BIT 14 , 452–459 (1974)], and makes use of recent results concerning the a posteriori correction of interpolatory cubic splines. 相似文献
68.
U. Wahl J. G. Correia E. Rita E. Alves J. C. Soares B. De Vries V. Matias A. Vantomme 《Hyperfine Interactions》2004,159(1-4):363-372
We present results of recent emission channeling experiments on the lattice location of implanted Fe and rare earths in wurtzite
GaN and ZnO. In both cases the majority of implanted atoms are found on substitutional cation sites. The root mean square
displacements from the ideal substitutional Ga and Zn sites are given and the stability of the Fe and rare earth lattice location
against thermal annealing is discussed. 相似文献
69.
R. Serna C. N. Afonso F. Catalina N. Teixeira M. F. da Silva J. C. Soares 《Applied Physics A: Materials Science & Processing》1992,54(6):538-542
Thin films consisting of 3 or 4 Sb and Ge alternating layers are irradiated with single nanosecond laser pulses (12 ns, 193 nm). Real time reflectivity (RTR) measurements are performed during irradiation, and Rutherford backscattering spectrometry (RBS) is used to obtain the concentration depth profiles before and after irradiation. Interdiffusion of the elements takes place at the layer interfaces within the liquid phase. The reflectivity transients allow to determine the laser energy thresholds both to induce and to saturate the process being both thresholds dependent on the multilayer configuration. It is found that the energy threshold to initiate the process is lower when Sb is at the surface while the saturation is reached at lower energy densities in those configurations with thinner layers. 相似文献
70.
Mamdouh Al-Harthi Long Shun Cheng João B. P. Soares Leonardo C. Simon 《Journal of polymer science. Part A, Polymer chemistry》2007,45(11):2212-2224
Bulk atom transfer radical polymerization (ATRP) of styrene was carried out at 110 °C using benzal bromide as bifunctional initiator and 1-bromoethyl benzene as monofunctional initiator. CuBr/2,2′-bipyridyl was used as the ATRP catalyst. The polymerization kinetic data for styrene with both initiators was measured and compared with a mathematical model based on the method of moments and another one using Monte Carlo simulation. An empirical correlation was incorporated into the model to account for diffusion-controlled termination reactions. Both models can predict monomer conversion, polymer molecular weight averages, and polydispersity index. In addition, the Monte Carlo model can also predict the full molecular weight distribution of the polymer. Our experimental results agree with our model predictions that bifunctional initiators can produce polymers with higher molecular weights and narrower molecular weight distributions than monofunctional initiators. © 2007 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 45: 2212–2224, 2007 相似文献