Degradation mechanism of benzodithiophene-based conjugated polymers when exposed to light in air.

We report the investigation of the air photostability of benzo[1,2-b:4,5-b']dithiophene (BDT) based conjugated polymers using UV-visible spectroscopy, X-ray photoelectron spectroscopy, gel permeation chromatography, and nuclear magnetic resonance spectroscopy. Three low band gap alternating D-A copolymers consisting of 3-fluoro-2-heptylcarbonylthieno[3,4-b]thiophene and alkyl-substituted BDT, alkoxy-substituted BDT, or dithienosilole, respectively, were prepared for investigating their photovoltaic performance and photostability. After only two hours of simultaneous exposure to light and air, the main absorption peak of the polymer films containing BDT units blue-shifted and its intensity dramatically decreased.

Azide-based cross-linking of polymers of intrinsic microporosity (PIMs) for condensable gas separation.

Cross-linked polymers of intrinsic microporosity (PIM)s for gas separation membranes, were prepared by a nitrene reaction from a representative PIM in the presence of two different diazide cross-linkers. The reaction temperature was optimized using TGA. The homogenous membranes were cast from THF solutions of different ratios of PIM to azides.

Polymer nanosieve membranes for CO2-capture applications.

Microporous organic polymers (MOPs) are of potential significance for gas storage, gas separation and low-dielectric applications. Among many approaches for obtaining such materials, solution-processable MOPs derived from rigid and contorted macromolecular structures are promising because of their excellent mass transport and mass exchange capability. Here we show a class of amorphous MOP, prepared by [2+3] cycloaddition modification of a polymer containing an aromatic nitrile group with an azide compound, showing super-permeable characteristics and outstanding CO(2) separation performance, even under polymer plasticization conditions such as CO(2)/light gas mixtures.

Ethanol enrichment from ethanol-water mixtures using high frequency ultrasonic atomization.

The influence of high frequency ultrasound on the enrichment of ethanol from ethanol-water mixtures was investigated. Experiments performed in a continuous enrichment system showed that the generated atomized mist was at a higher ethanol concentration than the feed and the enrichment ratio was higher than the vapor liquid equilibrium curve for ethanol-water above 40 mol%. Well-controlled experiments were performed to analyze the effect of physical parameters; temperature, carrier gas flow and collection height on the enrichment.

Synthesis, characterization and photovoltaic applications of a low band gap polymer based on s-tetrazine and dithienosilole.

A new copolymer of dithienosilole (DTS) and dithienyl-s-tetrazine (TTz), PDTSTTz, has been designed and synthesized. This solution processable polymer shows a low band gap, strong absorption and good thermal stability. Solar cells from the blend of this polymer with PC(71)BM showed power conversion efficiency (PCE) up to 4.

Development of a new s-tetrazine-based copolymer for efficient solar cells.

A new s-tetrazine-based low-bandgap semiconducting polymer, PCPDTTTz, was designed and synthesized. This is the first solution-processable conjugated polymer with tetrazine in the main chain. This polymer shows good thermal stability and broad absorption covering 450-700 nm.

Copolymers of Intrinsic Microporosity Based on 2,2',3,3'-Tetrahydroxy-1,1'-dinaphthyl.

A series of new copolymers with high molecular weight and low polydispersity, prepared from tetrahydroxydinaphthyl, tetrahydroxyspirobisindane, and tetrafluoroterephthalonitrile monomers, prevent efficient space packing of the stiff polymer chains and consequently show intrinsic microporosity. One copolymer, DNPIM-33, has an excellent combination of properties with good film-forming characteristics and gas transport performance, and exhibits higher selectivity than the corresponding spirobisindane-based homopolymer PIM-1 for gas pairs, such as O(2) /N(2) , with a corresponding small decrease in permeability. This work demonstrates that significant improvements in properties may be obtained through development of copolymers with intrinsic microporosity (CoPIMs) that extends the spectrum of high-molecular-weight ladder structures of poly(dibenzodioxane)s.

Crystalline low band-gap alternating indolocarbazole and benzothiadiazole-cored oligothiophene copolymer for organic solar cell applications.

A low band-gap alternating copolymer of indolocarbazole and benzothiadiazole-cored oligothiophene demonstrated balanced crystallinity and solubility; a solar cell combining this polymer with PC(61)BM in a preliminary test demonstrated power conversion efficiencies of 3.6%.

Kaolin polytypes revisited ab initio.

The well known 36 distinguishable transformations between adjacent kaolin layers are split into 20 energetically distinguishable transformations (EDT) and 16 enantiomorphic transformations, hereafter denoted EDT*. For infinitesimal energy contribution of interactions between non-adjacent layers, the lowest-energy models must result from either (a) repeated application of an EDT or (b) alternate application of an EDT and its EDT*. All modeling, quantum input preparation and interpretation was performed with Materials Toolkit, and quantum optimizations with VASP.

Two-dimensional imaging of soot volume fraction in laminar diffusion flames.

A technique for acquiring two-dimensional soot-volume-fraction measurements in laminar flames has been demonstrated. The technique provides a map of very low noise concentration over a range of wavelengths (250-1100 nm). A noise level of 0.

Diffuse-light two-dimensional line-of-sight attenuation for soot concentration measurements.

A technique of diffuse-light two-dimensional line-of-sight attenuation (diffuse 2D-LOSA) is described and demonstrated that achieves very high levels of sensitivity in transmissivity measurements (optical thicknesses down to 0.001) while effectively mitigating interferences due to beam steering. An optical system is described in which an arc lamp coupled with an integrating sphere is used as a source of diffuse light that is imaged to the center of the particulate laden medium.

Ab initio constrained crystal-chemical Rietveld refinement of Ca10(VxP1-xO4)6F2 apatites.

Extraction of reliable bond distances and angles for Ca10(VxP1-xO4)6F2 apatites using standard Rietveld refinement with Cu Kalpha X-ray powder data was significantly impaired by large imprecision for the O-atom coordinates. An initial attempt to apply crystal-chemical Rietveld refinements to the same compounds was partly successful, and exposed the problematic determination of two oxygen-metal-oxygen angles. Ab initio modeling with VASP in space groups P6(3)/m, P2(1)/m and Pm showed that both these angular parameters exhibited a linear dependence with the vanadium content.

Layered open pore poly(L-lactic acid) nanomorphology.

This paper reports on specific open and interconnected CO(2) foams of poly(L-lactic acid). The effect of varying gas concentration and hence physical changes induced by CO(2) has been investigated and thus used to generate specific structures. The developed morphologies have a skin core structure with larger pores in the core and open and interconnected smaller pores in the skin.

Cross-linkable bromo-fluorinated poly(arylene ether ketone)s for photonic device applications.

A series of novel cross-linkable bromo-fluorinated poly(arylene ether ketone)s have been synthesized and used to fabricate photonic devices. The polymers, prepared by polycondensation reactions of decafluorobenzophenone with mixtures of bisphenols in different ratios, exhibit excellent solubility in common organic solvents and can be easily cast into optical-quality thin films by spin coating. The materials are thermally stable with decomposition temperatures (Td, 5% weight loss) over 450 degrees C and have high glass transition temperatures (Tg) in the range of 164 degrees C-178 degrees C.

Microwave synthesis of polymer-embedded Pt-Ru catalyst for direct methanol fuel cell.

Platinum-ruthenium nanoparticles stabilized within a conductive polymer matrix are prepared using microwave heating. Polypyrrole di(2-ethylhexyl) sulfosuccinate, or PPyDEHS, has been chosen for its known electrical conductivity, thermal stability, and solubility in polar organic solvents. A scalable and quick two-step process is proposed to fabricate alloyed nanoparticles dispersed in PPyDEHS.

Design of Nanoparticles as Drug Carriers for Cancer Therapy.

This review explores the recent chemotherapeutic work on drug delivery using nanoparticles as carriers for the targeted treatment of cancer. Compared to direct drug delivery, delivery through a carrier can increase the efficacy of a drug, but decrease the side-effects by utilizing the enhanced permeability and retention (EPR) effect and tumor-specific targeting. The search for efficient and safe transport vehicles (carriers) to achieve better drug availability at the target site has been a challenging yet exciting area of research.

Laser-assisted synthesis of superparamagnetic Fe@Au core-shell nanoparticles.

A novel method combining wet chemistry for synthesis of an Fe core, 532 nm laser irradiation of Fe nanoparticles and Au powder in liquid medium for deposition of an Au shell, and sequential magnetic extraction/acid washing for purification has been developed to fabricate oxidation-resistant Fe@Au magnetic core-shell nanoparticles. The nanoparticles have been extensively characterized at various stages during and up to several months after completion of the synthesis by a suite of electron microscopy techniques (HRTEM, HAADF STEM, EDX), X-ray diffraction (XRD), UV-vis spectroscopy, inductively coupled plasma atomic emission spectroscopy, and magnetometry. The surface plasmon resonance of the Fe@Au nanoparticles is red shifted and much broadened as compared with that of pure colloidal nano-gold, which is explained to be predominantly a shell-thickness effect.

Geometrical parameterization of the crystal chemistry of P6(3)/m apatites: comparison with experimental data and ab initio results.

Experimental structure refinements and ab initio simulation results for 18 published, fully ordered P6(3)/m (A;{\rm I}_4)(A;{\rm II}_6)(BO4)6X2 apatite end-member compositions have been analyzed in terms of a geometric crystal-chemical model that allows the prediction of unit-cell parameters (a and c) and all atom coordinates. To an accuracy of +/- 0.025 A, the magnitude of c was reproduced from crystal-chemical parameters characterizing chains of .

A calibration-independent laser-induced incandescence technique for soot measurement by detecting absolute light intensity.

Laser-induced incandescence (LII) has proved to be a useful diagnostic tool for spatially and temporally resolved measurement of particulate (soot) volume fraction and primary particle size in a wide range of applications, such as steady flames, flickering flames, and Diesel engine exhausts. We present a novel LII technique for the determination of soot volume fraction by measuring the absolute incandescence intensity, avoiding the need for ex situ calibration that typically uses a source of particles with known soot volume fraction. The technique developed in this study further extends the capabilities of existing LII for making practical quantitative measurements of soot.

Experimental quantification of cavitation yield revisited: focus on high frequency ultrasound reactors.

Acoustic cavitation plays an important role in enhancing the reaction rate of chemical processes in sonochemical systems. However, quantification of cavitation intensity in sonochemical systems is generally limited to low frequency systems. In this study, an empirical determination of cavitation yield in high frequency ultrasound systems was performed by measuring the amount of iodine liberated from the oxidation of potassium iodide (KI) solution at 1.

Biodegradable open cell foams of telechelic poly(epsilon-caprolactone) macroligand with ruthenium (II) chromophoric subunits via sub-critical CO2 processing.

This work reports on the effect of CO2 at subcritical conditions and the gaseous state on the telechelic poly(epsilon-caprolactone) polymers. The tested polymers are semi-crystalline in nature and thus the effect of functional groups and their overall contribution to foaming and formation of microstructures with open-cell morphollogy is discussed.

Structure of 9,10-di(9,9-dioctylfluorenyl)anthracene in the solid and in solution.

A new example of magnetic nonequivalence of chemically equivalent atoms is identified from the proton and carbon resonance spectra of 9,10-di(9,9-dioctylfluorenyl)anthracene with the aid of its conformation in the crystalline state. Molecular modeling suggests that it has a similar conformation in solution.

Step-scan photoacoustic fourier transform and X-rays photoelectron spectroscopy of oil sands fine tailings: new structural insights.

The chemical and physical properties of clay suspensions from oil sands have profound effect not only on the bitumen extraction process but also on the tailing treatment and reclamation. Step-scan Photoacoustic Fourier Transform Infrared (S2PAS-FTIR) has been used to characterize the properties of clay suspensions. The photoacoustic spectral features of the fine solids (FS) fraction were found to vary drastically with the modulation frequency.

An Investigation of Odors and Volatile Organic Compounds Released during Composting.

The emissions of odors and volatile organic compounds produced from a commercial composting operation have been studied using a laboratory-scale composting system. The composting activity of a typical commercial compost feed was followed by monitoring the composting temperature, as well as the respiratory rate. Using a controlled aeration system, the gaseous volatiles produced were tested for odors using the "dilution-to-threshold" method, as well as gas composition, as determined by gas chromatography-mass spectrometry.

Comparison of Organic Compound Compositions in the Emissions Inventory and Ambient Data for the Lower Fraser Valley.

Weimin Jiang (corresponding author) is a research associate at the Institute for Chemical Process and Environmental Technology, National Research Council of Canada, Ottawa, Ontario, Canada K1A 0R6; phone: (613) 998-3992; e-mail: weimin.jiang@nrc.ca.