Charge Transport Calculation along Two-Dimensional Metal/Semiconductor/Metal Systems

Two-dimensional transistors are promising candidates for the next generation of nanoscale devices. Like the other alternatives, they also encounter problems such as instability under standard condition (STP), low channel mobility, small band gaps, and difficulty to integrate metal contacts. The latter poses a great challenge since metal/semiconductor interface significantly affects the transistor‘s performance. Some of these obstacles can be solved by using two-dimensional transition metal di-chalcogenides (TMDC) materials. In this study, we performed charge transport calculation based on density functional theory (DFT) followed by wave dynamics to evaluate the performance of six two-dimensional TMDC metal/semiconductor/metal systems. Each semiconductor monolayer was laterally connected, at both ends to metal contacts consisting of VS₂ or FeS₂ monolayers. We found that charge transport was more efficient in systems containing a CrS₂ semiconductor monolayer compared to systems with MoS₂ or WS₂ as the semiconductor monolayer. The electronic characterization of the monolayer TMDC materials by DFT estimates well the trend in charge transport efficiency calculated using wave packet dynamics.     

Mechanisms of molecular and structural interactions between lentil and quinoa proteins in aqueous solutions induced by pH recycling

There has been a growing interest in plant proteins due to their beneficial health effects, low cost and variety of applications in food industries. The low solubility of lentil proteins (LPs) is one of the significant factors that limit their use in food applications. Quinoa proteins (QPs), which have high water solubility, were combined with LPs at pH 12 to generate LP-QP complexes to generate pH-based soluble protein compounds. The LP-QP complexes demonstrated a large surface charge with an increase solubilisation of the protein complexes by more than 85%, together with resistance to protein aggregation. The combination of LPs to QPs led to a significant increase (P < 0.05) in unique tertiary and secondary protein structures as determined by the protein–protein interaction (PPI) technique involving pH recycling. Interactions between LPs and QPs affected the surface morphology of the protein complexes formed. Electrostatic interactions, hydrophobic forces and hydrogen bonding were indicated to play key roles in the PPIs. The capacity of pH cycling to illustrate the above protein interactions shows that this is a robust approach for assessing the emulsion and foaming properties of food proteins.     

SEARCHING FOR LEUKAEMIA CLUSTERS USING A GEOGRAPHICAL ANALYSIS MACHINE

ABSTRACT The paper describes a new approach to the graphical analysis of cancer data. A Geographical Analysis Machine is built which simultaneously solves the problems of post hot: hypothesis testing, handling data errors, and the task of generating and evaluating hypotheses in an exploratory environment. The methodology is demonstrated by reanalyzing cancer data for Northern England in such a way that for the first time the complex universe of all geographical hypotheses is enumerated, evaluated, and all the significant cancer clusters displayed.     

Sport Stadia, Sporting Events and Urban Development: International Experience and the Ambitions of Durban

The paper considers the stadium construction and infrastructure projects underway for World Cup 2010. We ask whether and under which conditions hosting such an event (along with the new facilities and infrastructural development required) will have positive effects on urban development. By analysing the stadium project in Durban, the paper also presents evidence on whether such positive effects may be enhanced by the attempt to create an image effect by seeking outstanding architectural quality of the new stadia.

Conditions for multiple land use in large-scale urban projects

The implementation of concepts of multiple land use seems to be relevant in the context of large-scale urban projects, which are now predominately monofunctional. However, current governance settings at these projects seem to be unreceptive to this new planning concept. Our in-depth case study of the South Axis project in Amsterdam embraces an actor-centred institutional perspective and seeks to understand how more receptive conditions for norm alignment between key actors can be attained. We reconstruct the introduction of quite radical concepts of multiple land use in this project, which started as an office-development proposal. The implementation was severely hampered by the fact that ambitions were formed in a rather introvert local government – business setting. Only in the last stage, with the adoption of a more extrovert mode of governance that included a variety of national government departments, were more receptive conditions for multiple land use created.     

The Anti-Inflammatory Effects of the Methanolic Extract and Fractions from Davilla elliptica St. Hil. (Dilleniaceae) on Bothrops jararaca Envenomation

Inflammation and haemorrhage are the main characteristics of tissue injury in botropic envenomation. Although some studies have shown that anti-venom prevents systemic reactions, it is not efficient in preventing tissue injury at the site of the bite. Therefore, this work was undertaken to investigate the anti-inflammatory effects of the methanolic extract and fractions from D. elliptica and to evaluate the role of matrix metalloproteinases (MMPs) in this process. Effects of the extract and fractions from D. elliptica were evaluated using a carrageenan-induced paw oedema model in rats, and leukocyte rolling was visualized by intravital. The quantification of MMPs activities (MMP-2 and MMP-9) extracted from the dermis of mice treated with extract and fractions alone or incubated with venom was determined by zymographic analyses. Our results show that intraperitoneal (i.p.) injection of fractions significantly reduced paw oedema after the carrageenan challenge. Treatment with the tannins fraction also resulted in considerable inhibition of the rolling of leukocytes and this fraction was able to decrease the activation of MMP-9. These results confirmed the anti-inflammatory activity of the methanolic extract and tannins fraction of D. elliptica and showed that the dermonecrosis properties of B. jararaca venom might be mediated through the inhibition of MMP-9 activity.     

Impact of precursor preparation on density of gadolinium iron garnets synthesized via reactive sintering

Gadolinium iron garnet was obtained from two different precursors, homogenized in isopropyl alcohol and in an aqueous environment with a fixed pH. In the first case, it was a mixture of goethite (FeO(OH)) and gadolinium oxide (Gd₂O₃); in the second, a mixture of GdIP (GdFeO₃) and α-Fe₂O₃. Conditions of homogenization in the aqueous environment were selected based on the zeta (ξ) potential measurements as the function of pH. DSC measurements of the output powder mixtures allowed the identification of the effects observed during the temperature rise. In the case of the material obtained from a mixture of goethite (FeO(OH)) and gadolinium oxide, with the increasing temperature, we observe three effects, the first of which corresponds to the phase transformation of goethite into α-Fe₂O₃, the second corresponds to the reaction of gadolinium iron perovskite (GdIP) formation, and the third to the reaction in which a gadolinium iron garnet (GdIG) is formed. However, in the case of heat treatment of the mixture of GdIP and α-Fe₂O₃, we only observe the effect responsible for a solid state reaction leading to the formation of gadolinium iron garnet. Dilatometric measurements allowed to determine the changes in linear dimensions at various stages of reaction sintering. The resulting materials were sintered at temperatures of 1200, 1300, and 1400 °C. In the case of the material obtained from a mixture of perovskite and iron (III) oxide, already at the temperature of 1300 °C, a density has been obtained at around 95% of the theoretical density, and the temperature of 1400 °C allowed achieving a density of 97% of the theoretical density. Whereas, for the material obtained from a mixture of goethite (FeO(OH)) and gadolinium oxide, a density above 95% of theoretical density was achieved only at 1400 °C.     

Extraction,optimisation and characterisation of phenolics from Thymus vulgaris L.: phenolic content and profiles in relation to antioxidant,antidiabetic and antihypertensive properties

The objectives of this study were to examine varying extraction conditions of Thymus vulgaris L. as related to phenolic content and profiles of the extracts and their antioxidant, antihypertensive and antidiabetic properties. Phenolics were extracted under various conditions pertaining to free and bound phenolics, solvent type and combination of extraction time and temperature, and these extracts were evaluated in terms of their antioxidant activities and inhibitory activities of angiotensin‐converting enzyme (ACE), α‐glucosidase and α‐amylase. The acetone–water solvent mixture (1:1; v/v) produced the extract with the greatest phenolic content, antioxidant activity and inhibitory activities of ACE and α‐glucosidase. The optimal extraction temperature for maximum phenolic content and antioxidant activity associated with methanol extraction was 60 °C, whereas a lower temperature at 40 °C was required to maximise inhibitory activities for ACE, α‐glucosidase and α‐amylase. An inverse relationship was seen between antioxidant and glucosidase inhibitory activities vs. the ACE and α‐amylase inhibitory activities, which suggests the need for extractions to be directed to specific bioactivities of thyme extracts. Generally, the results indicate major differences in phenolic profiles among the tested extraction conditions with thymol as the predominant phenolic seen in most extractions, while gallic acid, rosmarinic acid or diosmin also predominated in other extracts. Extracts with the same predominant phenolic compound and similar phenolic content showed major disparities in their ACE, glucosidase and α‐amylase inhibitory activities, indicating that the major phenolic profiles of thyme extracts may not be necessarily related to the degree of inhibition of ACE, glucosidase and α‐amylase enzymes.