Easily accessible oxygen‐containing derivatives of niobium pentachloride as catalytic precursors for ethylene polymerization

The low catalytic activity of NbCl₅ as an ethylene polymerization catalyst was significantly increased by the addition of a series of oxygen donors. The novel niobium derivatives NbCl₅(OPh₂) (1), NbCl₅(OEt₂) (3), NbCl₅(O?CPh₂) (5), NbCl₅(O?CHPh) (6), NbCl₅(O?CHMe) (7) and [NbCl₄(dppe)₂](NbCl₆) (18) (dppe is 1,2‐bis(diphenylphosphino)ethane) and the previously reported derivatives NbCl₅(OMePh) (2), NbCl₅(thf) (4) (thf is tetrahydrofuran), NbCl₅(O?CHOMe) (8), NbCl₅(O?CHNMe₂) (9), NbCl₅[O?C(NMe₂)₂] (10), NbCl₅(NCMe) (11), NbCl₄(κ²‐1,2‐OC₆H₄OMe) (12), NbCl₄[κ²‐O?C(Me)CH₂C(Me₂)O] (13), (14), [NbCl₄(O₂CMe)]₂ (15), NbCl₃(dme)(µ‐O)NbCl₅ (16) (dme is 1,2‐dimethoxyethane), [NbCl₄(κ²‐dmm)₂](NbCl₆) (17) (dmm is dimethylmaleate), TaCl₅(O?CMe₂) (19) and [TaCl₄(O₂CMe)]₂ (20) were tested as catalytic precursors in the ethylene polymerization reaction using AlMe₃‐depleted methylaluminoxane as co‐catalyst. Highly linear polyethylene was obtained. Compounds 1, 3, 5, 6 and 8–13 showed catalytic activities in the range 89–116 kg_polymer mol_Nb^?1 h^?1 bar^?1, i.e. comparable with the best performances reached with niobium pre‐catalysts up to now. However, the dinuclear compounds 14–16 and 18 were found to be less active, whereas17 and the tantalum derivatives 19 and 20 did not produce polymer. Relatively high molecular weights were achieved with the mononuclear compounds 1, 2, 8, 9, 10 and 12, the dinuclear 16 and the phosphine ionic 18. Copyright © 2011 Society of Chemical Industry     

n-Hexadecane hydroisomerization over Pt/ZSM-12: role of Si/Al ratio on product distribution

The crystallization of pure ZSM-12 phase was accomplished at Si/Al ratios ranging from 45 to 120 using tetraethylammonium bromide as the structure directing agent. The obtained samples were characterized by X-ray diffraction, scanning electron microscopy, temperature programmed desorption of ammonia, and nitrogen adsorption–desorption measurements at 77 K, respectively. The well characterized samples were used to prepare Pt (0.5 wt%)/ZSM-12 hydroisomerization catalysts which were employed to perform n-hexadecane isomerization reaction. The catalysts were compared in terms of their activity, selectivity and product distribution at different conversion levels obtained through variation in temperature and residence times. Thus, obtained trend for product distribution over Pt/ZSM-12 system has been discussed in terms of framework Si/Al ratio to understand its role in determining the product selectivity. ZSM-12 with Si/Al ratio of 120 depicted the highest overall selectivity and favored mono-branching while those having Si/Al ratio of 45, 60 and 90 were found to favor mutlti-branching.     

Solution of PDEs-electrically coupled systems with electrical analogy

This paper presents an approach to solve coupled systems where electrical/mechanical devices, whose behaviour is governed by a PDE or a system of PDEs, are connected together through an electrical circuit. In an earlier paper [1], it had been shown that PDEs can be modeled by an electrical equivalent circuit generated from the complete set of equations arising from the Finite Element Method (FEM). In this paper, the approach is extended to solve a system of PDEs. The approach allows the simulation of coupled systems with circuit simulation tools alone since the resultant system becomes an electrical circuit after an application of electrical analogy. The coupled system is solved by directly replacing PDE devices with the equivalent circuits. Further, a special circuit simulation technique, viz. multiport decomposition is used in order to solve a large coupled system. A sequential as well as a parallel simulator is built for coupled problems based on the proposed approach. A circuit with 100 linear PDE devices (the equivalent circuit contains 8 million nodes) has been simulated using the parallel simulator in less than 1 h. We have achieved a speedup of 5 over the sequential simulator using 8 processors on distributed memory architecture. The characteristic of p–n junction diode (drift–diffusion equation) is analyzed by our circuit simulator to show that the proposed approach can be used to build a circuit-cum-device simulator.     

Biodegradation Behavior of DOC Isolated Mixed Proteins-Based Plastic Sheets

The biodegradability of plastic sheets made of mixed proteins was investigated. Soybean, castor and rapeseed DOC (Deoiled Cake) isolated proteins-based plastic sheets were subjected to microbial degradation using Pseudomonas aeruginosa. Results from the microbial degradation showed that plastic sheets prepared from mixture of soybean, castor and rapeseed proteins could support the growth of P. aeruginosa. Biodegradable plastic sheet with composition (80:10:10 and 60% PEG₄₀₀) degraded much faster than the other four biodegradable plastics sheets under the conditions examined, suggesting that the biodegradability of protein films is associated with the film composition and the extent of covalent cross-linking.     

An EKV-based high voltage MOSFET model with improved mobility and drift model

An EKV-based high voltage MOSFET model is presented. The intrinsic channel model is derived based on the charge based EKV-formalism. An improved mobility model is used for the modeling of the intrinsic channel to improve the DC characteristics. The model uses second order dependence on the gate bias and an extra parameter for the smoothening of the saturation voltage of the intrinsic drain. An improved drift model [Chauhan YS, Anghel C, Krummenacher F, Ionescu AM, Declercq M, Gillon R, et al. A highly scalable high voltage MOSFET model. In: IEEE European solid-state device research conference (ESSDERC), September 2006. p. 270–3; Chauhan YS, Anghel C, Krummenacher F, Maier C, Gillon R, Bakeroot B, et al. Scalable general high voltage MOSFET model including quasi-saturation and self-heating effect. Solid State Electron 2006;50(11–12):1801–13] is used for the modeling of the drift region, which gives smoother transition on output characteristics and also models well the quasi-saturation region of high voltage MOSFETs. First, the model is validated on the numerical device simulation of the VDMOS transistor and then, on the measured characteristics of the SOI-LDMOS transistor. The accuracy of the model is better than our previous model [Chauhan YS, Anghel C, Krummenacher F, Maier C, Gillon R, Bakeroot B, et al. Scalable general high voltage MOSFET model including quasi-saturation and self-heating effect. Solid State Electron 2006;50(11–12):1801–13] especially in the quasi-saturation region of output characteristics.     

Rapid point-of-care testing methods/devices for meat species identification: A review

The authentication of animal species is an important issue due to an increasing trend of adulteration and mislabeling of animal species in processed meat products. Polymerase chain reaction is the most sensitive and specific technique for nucleic acid-based animal species detection. However, it is a time-consuming technique that requires costly thermocyclers and sophisticated labs. In recent times, there is a need of on-site detection by point-of-care (POC) testing methods and devices under low-resource settings. These POC devices must be affordable, sensitive, specific, user-friendly, rapid and robust, equipment free, and delivered to the end users. POC devices should also confirm the concept of micro total analysis system. This review discusses POC testing methods and devices that have been developed for meat species identification. Recent developments in lateral flow assay-based devices for the identification of animal species in meat products are also reviewed. Advancements in increasing the efficiency of lateral flow detection are also discussed.     

Determination of software release instant using a nonhomogeneous error detection rate model

The nonhomogeneous error detection rate model has been extensively used in software reliability modelling. An important management responsibility is to make a decision about the release of software, so as to result in maximum cost effectiveness. It is well known that the effort for correction of an error increases, rather heavily, from an initial testing phase to a final testing phase and then to the operational phase. In this paper, a method is presented to systematically determine this optimum release instant. The fact that some faults can be regenerated during the process of correction has also been considered in the modelling—this has been ignored in previous literature. Also, the partition of the testing phase into initial and final phases is considered to be desirable as effort per error correction will be significantly different in these two phases. An example illustrates the entire procedure for various values of the total number of errors and the trends of cost and release time.     

Simulation studies of atomic resolution X-ray holography

X-ray holography is a new method of structure determination based on measurement of interference of a known reference wave with an unknown object wave (containing information on atomic sites scattering the reference wave) so that phase information is preserved. Unlike X-ray diffraction, it does not demand for translational periodicity in the material. It is based on the idea similar to that of optical holography and has been tested on crystals, quasicrystals, thin films and doped semiconductors for their structure determination. In order to analyse potentials and limitations of this technique, we have carried out theoretical simulation studies on simple structures. In this paper we describe the basic algorithm of hologram generation and reconstruction of atomic positions from generated data. We illustrate this technique using Fe (bcc) single crystal as sample case to demonstrate its capabilities and limitations. Simulations were carried out on the Cu (fcc) structure and on complex structure such as the Al-Pd-Mn quasicrystal. Technical issues such as low signal to noise ratio, twin image problem etc have been discussed briefly to emphasize the need for high intensity X-ray source such as synchrotron for experiments and proper reconstruction algorithm. Finally the scope and potential of this technique have been discussed.