Non‐catalytic,gas‐solid reversible reaction mechanism implementing diffuse interface model

Gas‐solid reactions in chemical and metallurgical industries often involve solid pellets and a gaseous reactant. The progress of chemical reaction is measured by the movement of zones within the pellet and has been explained in terms of diffusion and chemical reaction processes. Earlier models identified a single reaction zone, in addition to product layer and unreacted core. In the present article, two reaction zones are envisaged as a more plausible explanation of the movement of the zones as the reaction proceeds. Earlier models for reversible reactions have assumed that conditions at the interface between the reaction zone and the unreacted core correspond to equilibrium at the prevailing temperature. The gaseous concentrations were assumed to permeate the core at the interfacial values so that no reaction occured in the core. More realistically, the present article envisages an additional zone within which the gaseous concentrations fall from the equilibrium values to zero. It is assumed that in the reaction zone proper, referred to as zone I, having thickness z_I, the concentration profile is sigmoidal. This agrees with the earlier work of Khan and Bowen [1] and Prasannan and Doraswamy. [2] In zone I and the concentration of the reactant gas varies between [A_i] and [A*]. In the zone II, having thickness z₂, concentration varies linearly between [A*] and zero. This model has been applied successfully to the data of the reduction of hematite [3] at different temperatures. The contribution of different forms of resistance, diffusion in product layer, chemical reaction and diffusion in the reactant core, is assessed as function of time (start to the end of reaction). The thickness of the zones remain almost constant as the reaction progresses. In particular, the influences of the product and core diffusion coefficients and chemical equilibrium constant on the extant reaction are evaluated. The dependence of concentration profile and zone thickness on equilibrium constant, K, velocity constant, k, diffusional coefficients D_C and D_P has been investigated thoroughly. The thickness of both zones has been evaluated for leading variables. © 1999 John Wiley & Sons, Inc. Int J Chem Kinet 31: 559–570, 1999     

Experimental Investigation on Thermophysical Properties of Ammonium-Based Protic Ionic Liquids and Their Potential Ability towards CO2 Capture

Ionic liquids, which are extensively known as low-melting-point salts, have received significant attention as the promising solvent for CO₂ capture. This work presents the synthesis, thermophysical properties and the CO₂ absorption of a series of ammonium cations coupled with carboxylate anions producing ammonium-based protic ionic liquids (PILs), namely 2-ethylhexylammonium pentanoate ([EHA][C5]), 2-ethylhexylammonium hexanoate ([EHA][C6]), 2-ethylhexylammonium heptanoate ([EHA][C7]), bis-(2-ethylhexyl)ammonium pentanoate ([BEHA][C5]), bis-(2-ethylhexyl)ammonium hexanoate ([BEHA][C6]) and bis-(2-ethylhexyl)ammonium heptanoate ([BEHA][C7]). The chemical structures of the PILs were confirmed by using Nuclear Magnetic Resonance (NMR) spectroscopy while the density (ρ) and the dynamic viscosity (η) of the PILs were determined and analyzed in a range from 293.15K up to 363.15K. The refractive index (n_D) was also measured at T = (293.15 to 333.15) K. Thermal analyses conducted via a thermogravimetric analyzer (TGA) and differential scanning calorimeter (DSC) indicated that all PILs have the thermal decomposition temperature, T_d of greater than 416K and the presence of glass transition, T_g was detected in each PIL. The CO₂ absorption of the PILs was studied up to 29 bar at 298.15 K and the experimental results showed that [BEHA][C7] had the highest CO₂ absorption with 0.78 mol at 29 bar. The CO₂ absorption values increase in the order of [C5] < [C6] < [C7] anion regardless of the nature of the cation.     

Investigation of the Optical Properties of a Novel Class of Quinoline Derivatives and Their Random Laser Properties Using ZnO Nanoparticles

Quinoline Schiff bases display potential applications in optoelectronics and laser fields because of their unique optical properties that arise from extensive delocalization of the electron cloud, and a high order of non-linearity. In this context, a new class of conjugated quinoline-derivative viz. N-(quinolin-3-ylmethylene)anilines were synthesized from 2-hydroxyquinoline-3-carbaldehyde in two good yielding steps. The ability of these imines to accept an electron from a donor is denoted by their electron acceptor number and sites, which is calculated using density functional theory (DFT). The optical properties such as FT-IR, Raman, UV-VIS, and EDS spectra were calculated using TD-DFT, which also provided the energy gap, HOMO-LUMO structure. The optical properties of the synthesized imino quinolines were experimentally studied using photoluminescence and absorption spectroscopy. The properties such as Stokes shift and quantum yield were calculated using experimental data. Furthermore, the compound bearing a methyl group on the aryl ring and ZnO nanoparticles (hydrothermally synthesized) were dissolved in toluene, and optically excited with a 355 nm nanosecond laser, which produced a random laser.     

Non-statistical fluctuations in 16O-AgBr interaction at 60A GeV in terms of factorial correlators

An analysis of ¹⁶O-AgBr interaction data at 60A GeV in terms of factorial correlators is presented. The correlated moments are found to increase with decreasing bin-bin separation D, following a power law within the region D 1. The data are also consistent with the dimension-independent scaling relation proposed by Seixas. Received: 5 October 1998 / Accepted: 20 April 2000     

Mixed logic and storage operators

In 1990 J-L. Krivine introduced the notion of storage operators. They are -terms which simulate call-by-value in the call-by-name strategy and they can be used in order to modelize assignment instructions. J-L. Krivine has shown that there is a very simple second order type in AF2 type system for storage operators using G?del translation of classical to intuitionistic logic. In order to modelize the control operators, J-L. Krivine has extended the system AF2 to the classical logic. In his system the property of the unicity of integers representation is lost, but he has shown that storage operators typable in the system AF2 can be used to find the values of classical integers. In this paper, we present a new classical type system based on a logical system called mixed logic. We prove that in this system we can characterize, by types, the storage operators and the control operators. Received: 7 May 1997     

An Integrated Fuzzy Analytic Hierarchy Process (AHP) Model for Studying Significant Factors Associated with Frequent Lane Changing

Frequent lane changes cause serious traffic safety concerns, which involve fatalities and serious injuries. This phenomenon is affected by several significant factors related to road safety. The detection and classification of significant factors affecting lane changing could help reduce frequent lane changing risk. The principal objective of this research is to estimate and prioritize the nominated crucial criteria and sub-criteria based on participants’ answers on a designated questionnaire survey. In doing so, this paper constructs a hierarchical lane-change model based on the concept of the analytic hierarchy process (AHP) with two levels of the most concerning attributes. Accordingly, the fuzzy analytic hierarchy process (FAHP) procedure was applied utilizing fuzzy scale to evaluate precisely the most influential factors affecting lane changing, which will decrease uncertainty in the evaluation process. Based on the final measured weights for level 1, FAHP model estimation results revealed that the most influential variable affecting lane-changing is ‘traffic characteristics’. In contrast, compared to other specified factors, ‘light conditions’ was found to be the least critical factor related to driver lane-change maneuvers. For level 2, the FAHP model results showed ‘traffic volume’ as the most critical factor influencing the lane changes operations, followed by ‘speed’. The objectivity of the model was supported by sensitivity analyses that examined a range for weights’ values and those corresponding to alternative values. Based on the evaluated results, stakeholders can determine strategic policy by considering and placing more emphasis on the highlighted risk factors associated with lane changing to improve road safety. In conclusion, the finding provides the usefulness of the fuzzy analytic hierarchy process to review lane-changing risks for road safety.     

A Mechanistic Overview of the Current Status and Future Challenges of Aluminum Anode and Electrolyte in Aluminum-Air Batteries

Aluminum-air batteries (AABs) are regarded as attractive candidates for usage as an electric vehicle power source due to their high theoretical energy density (8100 Wh kg⁻¹), which is considerably higher than that of lithium-ion batteries. However, AABs have several issues with commercial applications. In this review, we outline the difficulties and most recent developments in AABs technology, including electrolytes and aluminum anodes, as well as their mechanistic understanding. First, the impact of the Al anode and alloying on battery performance is discussed. Then we focus on the impact of electrolytes on battery performances. The possibility of enhancing electrochemical performances by adding inhibitors to electrolytes is also investigated. Additionally, the use of aqueous and non-aqueous electrolytes in AABs is also discussed. Finally, the challenges and potential future research areas for the advancement of AABs are suggested.     

Formation and dissolution of phase-separated structures in ultrathin blend films

The phase separation of ultrathin polymer blend films of deuterated poly(styrene)/poly(vinylmethylether) leads to a variety of film morphologies, depending on polymer composition. Phase-separation measurements are made at a constant temperature difference from the critical temperature, leading to a bicontinuous spinodal decomposition pattern for near-critical blend compositions and to “mounds” and “holes” for PVME-rich and dPS-rich off-critical mixtures, respectively. Reverse temperature jumps of the phase-separated blend films into the one-phase region result in dissolution of the undulating surface patterns, confirming the phase-separation origin of the film patterns. © 1998 John Wiley & Sons, Inc. J Polym Sci B: Polym Phys 36 : 191–200, 1998     

Hydroxypropylcellulose-aceclofenac conjugates: high covalent loading design, structure characterization, nano-assemblies and thermal kinetics

This article presents synthesis of novel macromolecular prodrugs of aceclofenac (an anti-inflammatory drug) onto hydroxypropylcellulose (HPC). The HPC-aceclofenac conjugates were prepared using an acylating agent 1,1′-carbonyldiimidazole (CDI) under homogenous reaction conditions. Aceclofenac was first activated by using CDI to form its N-acylimidazole. The N-acylimidazole of aceclofenac was then reacted with HPC polymer at 80 °C for 24 h. Highly pure prodrugs of aceclofenac were synthesized with a wide range of moderate to high degree of substitution (DS 0.41–2.12) as calculated by ¹H NMR spectroscopy. The UV spectroscopic analysis has also revealed that the active drug aceclofenac was found in different conjugates from 28 to 67 mg/100 mg of HPC-aceclofenac conjugates which are in good agreement with DS calculated by ¹H NMR spectroscopy. The gel permeation chromatography showed unimodal absorption that indicates no significant degradation in polymer chains during the reaction. The macromolecular prodrugs of aceclofenac were characterized using different spectroscopic and chromatographic techniques. The thermal analysis has revealed that HPC-aceclofenac conjugates (prodrugs) are 92 and 96 °C more stable than pure aceclofenac regarding their initial (Tdi) and maximum degradation temperatures (Tdm), respectively. The activation energy (Ea) and frequency factor (Z) of the degradation reactions were evaluated using Friedman, Broido and Chang methods. Degradation followed first order (n) kinetics. Transmission electron microscopy has revealed the formation of sponge like nano aggregates with population size distribution of around 80–150 nm.     

Detection of hippuric acid: A glue solvent metabolite,using a mobile test kit

Many testing kits for screening common drugs are widely used in Malaysia, such as the dip strip urine drug testing kit which is specified for detecting drug in abuser. However, currently there is no specific testing kit for screening urine samples to detect glue abusers. This research is dedicated to develop a specific color test method to emphasize the screening for glue abusers, known as G.S. Kit. It contains benzenesulphonyl chloride, pyridine and distilled water. The urine sample is mixed with pyridine and benzenesulphonyl chloride and followed by distilled water. A positive result will be in the form of a color reaction from yellow to red. This novel G.S. Kit would be quite useful for the screening and detection of glue sniffing and toluene abusing qualitatively, as a way of helping National Anti Drug Agency, Department of Education and Royal Police of Malaysia in preventing glue sniffing from becoming a social pandemic.