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991.
P. Lugli C. Erlen A. Pecchia F. Brunetti L. Latessa A. Bolognesi G. Csaba G. Scarpa A. di Carlo 《Applied Physics A: Materials Science & Processing》2007,87(3):593-598
Molecular devices have lately attracted increased attention due to some appealing features such as their low production cost,
flexibility in the substrate choice, possibility of large area deployment, and possibly higher integration capabilities. Starting
from a series of results obtained from our groups, we critically review the state-of-the-art in the field of simulation of
organic and molecular systems, by analyzing and comparing existing approaches, and looking at the open problems and possible
solutions and future developments.
PACS 72.80.Le 相似文献
992.
Panagiota G. Fragouli Hermis Iatrou Nikos Hadjichristidis Takuro Sakurai Akira Hirao 《Journal of polymer science. Part A, Polymer chemistry》2006,44(1):614-619
3‐Miktoarm star copolymers, 3μ‐D2V, with two poly(dimethylsiloxane) (PDMS) and one poly(2‐vinylpyridine) (P2VP) arm, were synthesized by using anionic polymerization–high vacuum techniques and (chloromethylphenylethyl)methyl dichlorosilane, heterofunctional linking agent, with two SiCl groups and one CH2Cl group. The synthetic strategy involves the selective reaction of the two ? SiCl groups with PDMSOLi living chains, followed by reaction of the remaining chloromethyl group with P2VPLi. Combined molecular characterization results (size exclusion chromatography, membrane osmometry, and 1H NMR spectroscopy) revealed a high degree of structural and compositional homogeneity. © 2005 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 44: 614–619, 2006 相似文献
993.
G. Lligadas J. C. Ronda M. Gali V. Cdiz 《Journal of polymer science. Part A, Polymer chemistry》2006,44(19):5630-5644
A new phosphorous‐containing fatty acid diepoxide was obtained from 10‐undecenoyl chloride and 10‐(2′,5′‐dihydroxyphenyl)‐9,10‐dihydro‐9‐oxa‐10‐phosphaphenanthrene‐10‐oxide and crosslinked with 4,4′‐diaminodiphenylmethane and bis(m‐aminophenyl)methylphosphine oxide. The properties of the thermosetting materials were evaluated by differential scanning calorimetry, dynamic mechanical thermal analysis, thermogravimetric analysis, and limiting oxygen index (LOI). Thermal and thermooxidative degradation was studied by gas chromatography/mass spectrometry, FTIR, 31P magic angle spinning NMR spectroscopy, and scanning electron microscopy. LOI values indicate good flame‐retardant properties that are related to the formation of a protective phosphorous‐rich layer that slowed down the degradation and prevented it from being total. © 2006 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 44: 5630–5644, 2006 相似文献
994.
Ahmed Iraqi Ruth C. Pegington Timothy G. Simmance 《Journal of polymer science. Part A, Polymer chemistry》2006,44(10):3336-3342
The postmodification of poly[9‐(2‐hexyldecyl)‐9H‐carbazole‐2,7‐diyl] ( P1 ) upon its reaction with N‐bromosuccinimide affords exclusive and full bromination of the 3,6‐positions of the carbazole repeat units to yield poly[3,6‐dibromo‐9‐(2‐hexyldecyl)‐9H‐carbazole‐2,7‐diyl] ( P2 ). Brominated polymer P2 can be used as a precursor for further functionalization at the 3,6‐positions with the desired functional group to afford other useful polymers. Polymer P2 has hence been reacted with copper(I) cyanide to afford poly[3,6‐dicyano‐9‐(2‐hexyldecyl)‐9H‐carbazole‐2,7‐diyl] ( P3 ). Full substitution of the bromide groups with nitrile‐functional groups has been achieved. The preparation and structural characterization of polymers P2 and P3 are presented together with studies on their electronic conjugation and photoluminescence properties. Cyclic voltammetry studies on polymer P3 indicate that the new polymer is easier to reduce (n‐dope) but more difficult to oxidize than its unsubstituted counterpart ( P1 ) as a result of the introduction of the electron‐withdrawing nitrile‐functional groups at the 3,6‐positions on the carbazole repeat units on the polymer chains. © 2006 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 44: 3336–3342, 2006 相似文献
995.
J. Daum G. Erdodi J. P. Kennedy 《Journal of polymer science. Part A, Polymer chemistry》2006,44(13):4053-4062
The synthesis and characterization of two groups of novel networks prepared from cyclolinear polysiloxanes are described. The first group of networks from cyclolinear polysiloxanes (N‐CLPSs) was synthesized by the hydrosilation of vinyl‐terminated cyclolinear polyorganosiloxanes [prepared from diacetoxydiethyltetramethylcyclotetrasiloxane (D4Et2OAc2) or diacetoxytriethylpentamethylcyclopentasiloxane (D5Et3OAc2)] with a copolymer of dimethylsiloxane and methylhydrosiloxane as the crosslinking agent. Hydrosilation was effected with a platinum carbonyl catalyst with a cyclovinylsiloxane moderator. The second group of networks (N‐eCLPSs) was prepared similarly with extended cyclolinear polysiloxanes. The mechanical properties of the novel networks were comparable to those of polydimethylsiloxane networks (N‐PDMS). The oxygen permeabilities were similar to or slightly higher than that of N‐PDMS. The glass‐transition temperatures of D4Et2OAc2‐ and D5Et3OAc2‐based N‐CLPSs were ?67.8 and ?90.8 °C, respectively, whereas the incorporation of polydimethylsiloxane spacers into similar N‐eCLPSs lowered their glass‐transition temperatures to ?109.7 and ?115.0 °C. Upon heating to 800 °C in air, N‐CLPSs yielded more residue than N‐eCLPSs, which in turn yielded more residue than N‐PDMS. These results may have been due to the presence of T units in the cyclic siloxane units, which may have inhibited chain degradation or the formation of volatile products. © 2006 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 44: 4053–4062, 2006 相似文献
996.
Marco Sangermano Roberta Bongiovanni Giulio Malucelli Aldo Priola Richard R. Thomas Charles M. Kausch Yongsin Kim 《Journal of polymer science. Part A, Polymer chemistry》2006,44(24):6943-6951
New fluorinated, polyfunctional propenyl ether functionalized resins were synthesized, and their behavior in cationic photopolymerization was investigated. The photopolymerization proceeded efficiently with a high double‐bond conversion (>90%), giving rise to UV‐cured coatings characterized by low glass‐transition temperatures (?33 °C ≤ glass‐transition temperature ≤ ?15 °C) and hydrophobic surface properties. A fluorinated additive was also employed as a reactive additive in the cationic photopolymerization of trimethylolpropane tripropenyl ether, increasing the double‐bond conversion, polymer network flexibility, thermal stability, and surface hydrophobicity. © 2006 Wiley Periodicals, Inc. J Polym Sci Part A: Polym Chem 44: 6943–6951, 2006 相似文献
997.
Olga Ordeig Craig E Banks Trevor J Davies F Javier del Campo Francesc Xavier Mu?oz Richard G Compton 《Analytical sciences》2006,22(5):679-683
Gold ultra-microelectrode arrays are used to explore the electrochemical oxidation of hydroxide ions and are shown to be analytical useful. Two types of ultra-microelectrode arrays are used; the first consist of 256 individual electrodes of 5 microm in radius, 170 of which are electrochemically active in a cubic arrangement which are separated from their nearest neighbour by a distance of 100 microm. The second array compromises 2597 electrodes of 2.5 microm in radius and of which 1550 of which are electrochemically active in a hexagonal arrangement separated by the nearest neighbour by 55 microm. Well defined voltammetric waves are found with peak currents proportional to the concentration of hydroxide ions in the range 50 microM to 1 mM. Detection limits of 20 microM using the 170 ultra-microelectrode and 10 microM with the 1550 ultra-microelectrode array are shown to be possible but with a higher sensitivity of 4 mA M(-1) observed using the 1550 ultra-microelectrode array compared to 1.2 mA M(-1) with the 170 ultra-microelectrode array. 相似文献
998.
M. B. Babanly G. M. Guseinov D. M. Babanly F. M. Sadygov 《Russian Journal of Inorganic Chemistry》2006,51(5):810-813
The polythermal sections TlBr-Tl2S, TlBr-Tl4S3, TlBr-TlS, and Tl6SBr4-Tl; the isothermal section at 300 K of the phase diagram; and the projection of the liquidus surface of the Tl-S-Br system have been investigated in the composition region Tl-TlBr-S by DTA, X-ray powder diffraction analysis, and microhardness measurements. The primary crystallization regions, including that of the only ternary compound (Tl6SBr4), have been determined, and the types and coordinates of the invariant and univariant equilibria in the phase diagram are determined. 相似文献
999.
G. M. Mamardashvili R. S. Kumeev N. Zh. Mamardashvili 《Russian Journal of Inorganic Chemistry》2006,51(8):1264-1269
The formation of host-guest complexes between dimeric cyclophane zinc diphenylporphyrinates and bidentate ligands of different nature containing two nitrogen atoms has been studied by the spectrophotometric titration method and 1H NMR spectroscopy in a toluene-methanol (2: 1) binary solvent. The complexation of these dimeric porphyrinates with 1,4-diazabicyclo[2,2,2]octane or pyrazine can lead to 1: 1 or 1: 2 complexes, depending on the metalloporphyrin-to-ligand molar ratio. The stability constants of the porphyrinate-ligand complexes and concentration ranges of their formation have been determined. 相似文献
1000.
J.-S. Kang G. Kim S.S. Lee S. Choi S. Cho S.W. Han H.J. Shin B.I. Min 《Journal of magnetism and magnetic materials》2006
The spatial concentration distribution and local electronic structure of ferromagnetic Ge1−xTx (T=Cr, Mn, Fe) DMS single crystals have been investigated by using scanning photoelectron microscopy (SPEM), X-ray absorption spectroscopy (XAS), and photoemission spectroscopy (PES). It is found that doped T ions in Ge1−xTx crystals are chemically phase-separated, suggesting that the observed ferromagnetism arises from the phase-separated T-rich phases in Ge1−xTx. 相似文献