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171.
The aim of this paper is characterisation of mesomorphic properties and helical structure parameters: handedness and helical pitch, of two laterally substituted ferroelectric compounds and mixtures based on them. These compounds have the same quaterphenyl rigid core and the same length of non-chiral chain – eight carbon atoms, as well as the absolute configuration of chiral centre (‘R’). Base compounds differ in the kind of a substituent in a rigid core (–Cl, –CH3). Both of them have rather low melting temperature in comparison to most of quaterphenyls, and it affects the lowering of this temperature in binary mixtures. Thus they can be used for preparation of multicomponent ferroelectric mixtures useful for application. 相似文献
172.
Unconventional basis functions, constructed from exponential type orbitals (ETOs) with hyperbolic cosine functions, are applied to Roothaan-Hartree-Fock calculations of atoms within the minimal basis sets framework. The most popular ETOs, Slater type orbitals, B functions and \(\psi ^{(\alpha ^*)}\) functions with \(\alpha ^*=2\), and two types of hyperbolic cosine functions, \(\cosh (\beta r)\) and \(\cosh (\beta r+\gamma )\), are used in this work. The performance of the present basis functions is investigated and compared to the conventional double-zeta Slater-type basis set and numerical Hartree-Fock results. The improvement in the atomic energies clearly demonstrates how the accuracy increases when we move from ETO to ETO with hyperbolic cosine basis functions. The resulting improved minimal basis sets can also be useful in molecular calculations. 相似文献
173.
J. Pan Y. L. Li C. M. Liu Y. Tian S. Yu K. L. Wang J. Zhang J. Fang 《Plasma Chemistry and Plasma Processing》2017,37(4):1091-1103
The disinfection of the inner surface of a medical device has long been a challenge for the central sterile supply departments. Dental unit waterline system (DUWLs) foster the attachment of microorganisms and development of biofilm, which lead to continuous contamination of the outlet water from dental units; this contamination may be responsible for a potential risk of infection due to the exposure of patients and medical staff. The present study investigated the disinfection effects of cold atmospheric plasma-activated water (CAPAW) on DUWLs using a model of 5-day-old Enterococcus faecalis biofilm. The results showed that the colony-forming unit was reduced from 107 to 0 after 5 min of treatment. The physicochemical properties of CAPAW were evaluated, including the pH value, oxidation reduction potential, and NO radical. The results showed that the inactivation mechanisms were mainly triggered by the reactive oxygen/nitrogen species. Additionally, CAPAW had a metal corrosion rate same as that of deionized water. We conclude that CAPAW can be applied as an appropriate alternative disinfectant against biofilm contamination of DUWLs. 相似文献
174.
R. Renganath Rao M. Vimudha N. R. Kamini M. K. Gowthaman B. Chandrasekran P. Saravanan 《Applied biochemistry and biotechnology》2017,182(2):511-528
Enzyme-based unhairing in replacement of conventional lime sulfide system has been attempted as an alternative for tackling pollution. The exorbitant cost of enzyme and the need for stringent process control need to be addressed yet. This study developed a mechanism for regulated release of protease from cheaper agro-wastes, which overcomes the necessity for stringent process control along with total cost reduction. The maximum protease activity of 1193.77 U/g was obtained after 96 h of incubation with 15% inoculum of the actinomycete strain Brevibacterium luteolum (MTCC 5982) under solid-state fermentation (SSF). The medium after SSF was used for unhairing without the downstream processing to avoid the cost involved in enzyme extraction. This also helped in the regulated release of enzyme from bran to the process liquor for controlled unhairing and avoided the problem of grain-pitting. Unhairing process parameters were standardized as 20% enzyme offer, 40% Hide-Float ratio at 5 ± 1 rpm, and process pH of 9.0. The cost of production of 1000 kU of the protease was calculated as 0.44 USD. The techno-economic feasibility studies for setting up an SSF enzyme production plant showed a high return on investment of 15.58% with a payback period of 6.4 years. 相似文献
175.
Two composite supports with a mixed inorganic–organic structure were synthesized: BTAl and UTAl. Hydrophilic–hydrophobic dual properties of the supports were suitable for preparing egg-shell-supported metal catalysts for selective hydrogenation reactions. The catalysts were characterized by ICP, XRD, OM, TEM, EPMA, XPS and TGA. Their mechanical resistance was assessed. Activity and selectivity were tested with the hydrogenation of 2,3-butanedione (diacetyl) to 3-hydroxy-2-butanoneacetoin (acetoin). The same order of increasing metal particle size was found for the two tested supports: Pt < Ru < Pd. The XPS analysis showed that the metal/composite catalysts reduced in H2 at 503 K had two kinds of active sites: reduced (Me°) and electron-deficient (Me+). It was rationalized that the hydrogen bond cleavage was performed on the Me° active sites, while reactant adsorption occurred on the Me+ sites. The differences in activity and selectivity between the composite catalysts were attributed to electronic effects on the different metals and to different adsorptive properties of the different polymers. The high selectivity to acetoin was attributed to the preferential adsorption of diacetyl as compared to the adsorption of acetoin. The BTAl catalysts were slightly more active and selective than the UTAl ones. This was attributed to electronic effects caused by remnant organic groups on the composite supports (urethane or biphenyl on UTAl or BTAl, respectively). Pd-BTAl was the most active and selective catalyst, a fact related to electronic effects of both palladium and the support. 相似文献
176.
Johanna Méndez Arias Anelize de Oliveira Moraes Luiz Felipe Amarante Modesto Aline Machado de Castro Nei Pereira Jr 《Applied biochemistry and biotechnology》2017,181(2):593-603
Poly(ethylene glycol) (PEG 4000) and bovine serum albumin (BSA) were investigated with the purpose of evaluating their influence on enzymatic hydrolysis of sugarcane bagasse. Effects of these supplements were assayed for different enzymatic cocktails (Trichoderma harzianum and Penicillium funiculosum) that acted on lignocellulosic material submitted to different pretreatment methods with varying solid (25 and 100 g/L) and protein (7.5 and 20 mg/g cellulose) loadings. The highest levels of glucose release were achieved using partially delignified cellulignin as substrate, along with the T. harzianum cocktail: increases of 14 and 18 % for 25 g/L solid loadings and of 33 and 43 % for 100 g/L solid loadings were reached for BSA and PEG supplementation, respectively. Addition of these supplements could maintain hydrolysis yield even for higher solid loadings, but for higher enzymatic cocktail protein loadings, increases in glucose release were not observed. Results indicate that synergism might occur among these additives and cellulase and xylanases. The use of these supplements, besides depending on factors such as pretreatment method of sugarcane bagasse, enzymatic cocktails composition, and solid and protein loadings, may not always lead to positive effects on the hydrolysis of lignocellulosic material, making it necessary further statistical studies, according to process conditions. 相似文献
177.
Poly(dodecylmethacrylate-co-methyleugenol) P(DDMA-co-Meu) and poly(dodecylmethacrylate-co-methylchavicol) P(DDMA-co-Mch) gels were synthesized in ethanol using free radical cross-linking polymerization method at 60 °C for 24 h in the presence of azobisisobutyronitrile (AIBN) and triethylene glycol dimethacrylate (TEGDMA) as initiator and cross-linker, respectively. Scanning electron microscopy (SEM) and Fourier transform infrared spectroscopy (FTIR) were used to characterize the gels. These gels were used to investigate swelling behaviors in linalool and methyl eugenol, in essential oil mixture of phenyl propanoid and terpenoid, and also in various solvents. While the equilibrium swelling values (ESV) of both gels were higher in linalool than in methyl eugenol, the result was vice versa in the case of essential oil mixture. ESVs of both gels were also obtained in various solvents with different functional groups and the highest ESV of both gels were obtained in toluene, and the lowest ESV of P(DDMA-co-Meu) and P(DDMA-co-Mch) was in methanol and in ethylene glycol, respectively. While P(DDMA-co-Meu) is sensitive to carbon number change in alcohol, P(DDMA-co-Mch) is less sensitive. In the case of esters, increase of carbon number in functional group causes a more significant change in ESV than an increase of carbon number in aliphatic chain. Experimental results were correlated by the first-order and second-order models. The second-order model was more suitable than the other. While P(DDMA-co-Meu) gel swelled in linalool exhibits a Fickian diffusion character, the diffusion mechanism of the gel in methyl eugenol is a non-Fickian one. In the case of P(DDMA-co-Mch), the result is vice versa. 相似文献
178.
C. Orofino C. Foucher F. Farrell N. J. Findlay B. Breig A. L. Kanibolotsky B. Guilhabert F. Vilela N. Laurand M. D. Dawson P. J. Skabara 《Journal of polymer science. Part A, Polymer chemistry》2017,55(4):734-746
A series of star-shaped oligofluorene molecules, each containing a TPE core, have been specifically designed and produced to show effective aggregation-induced emission (AIE). Each molecule differs either in the number of fluorene units within the arms (e.g., 1 or 4, compounds 4 and 5 ), or the terminal group positioned at the end of each arm (e.g., H, TMS, or TPA, compounds 4 , 6 , and 7 ). Although they are all poor emitters in solution phase they become efficient yellow-green luminogens in the condensed state. Their AIE properties were investigated in THF/H2O mixtures, with each molecule exhibiting a clear emission enhancement at specific water contents. An all-organic distributed feedback (DFB) laser was fabricated using compound 4 as the gain material and exhibited an average threshold energy fluence of 60 ± 6 μJ/cm2 and emission in the green region. Furthermore, piezofluorochromism studies on a thin film of this material displayed a linear dependence of the amplified spontaneous emission (ASE) peak position on applied pressure, indicating potential applications as lasing-based pressure sensors. © 2016 The Authors. Journal of Polymer Science Part A: Polymer Chemistry Published by Wiley Periodicals, Inc. J. Polym. Sci., Part A: Polym. Chem. 2017 , 55, 734–746 相似文献
179.
P. M. Pakhomov V. P. Galitsyn S. D. Khizhnyak A. E. Chmel 《Polymer Science Series A》2017,59(4):592-603
This paper concerns the basics of using longwave (low-frequency) Raman spectroscopy in the region of a longitudinal acoustic mode for the study of structural features of polymers. Using ultrahighmolecular- weight polyethylene (UHMW PE)-based reactor powders, gels, and oriented fibers obtained by the gel technology, the length distribution of straight-chain segments and its relation to the morphology of the sample were analyzed. An important role of the low-frequency Raman spectroscopy in creating domestic gel technology for preparing ultrahigh-strength threads from polyethylene was demonstrated. 相似文献
180.
Leona M. Fahey Michél K. Nieuwoudt Philip J. Harris 《Cellulose (London, England)》2017,24(12):5275-5293
Because plant cell walls vary in their polysaccharide compositions and lignin contents, their monosaccharide compositions and lignin contents are often determined, but these analyses are time consuming and laborious. We therefore investigated Fourier transform infrared (FTIR) spectroscopy coupled with partial least squares (PLS) regression analysis as a way of rapidly predicting the monosaccharide compositions and lignin contents of the cell walls of compression wood (CW) and opposite wood (OW) of the gymnosperm Pinus radiata. The effects were investigated of sample moisture content (ambient or dry) and sample particle size (large particles, < 0.422 mm or small particles, < 0.178 mm) of milled wood on attenuated total reflectance (ATR) and transmission FTIR spectra, as well as the PLS-1 models and subsequent predictions. PLS-1 models were built using mixtures of CW and OW as the training set, to provide a linear range of monosaccharide compositions and lignin contents. Models were externally validated by predicting another set of wood mixtures before predicting CW and OW of a separate test set. Most of the monosaccharide amounts in the separate test set were best predicted by ATR spectroscopy of ambient large particles, achieving the lowest standard error values for the monosaccharides arabinose (0.36%), xylose (1.05%), galactose (1.79%), glucose (6.32%), and 4-O-methylglucuronic acid (0.20%). The results show the feasibility of using ATR spectroscopy of ambient large particles for the rapid prediction of monosaccharide compositions and lignin contents of plant cell walls. 相似文献