Facile Surfactant-Free Synthesis of p-Type SnSe Nanoplates with Exceptional Thermoelectric Power Factors.

A surfactant-free solution methodology, simply using water as a solvent, has been developed for the straightforward synthesis of single-phase orthorhombic SnSe nanoplates in gram quantities. Individual nanoplates are composed of {100} surfaces with {011} edge facets. Hot-pressed nanostructured compacts (Eg ≈0.85 eV) exhibit excellent electrical conductivity and thermoelectric power factors (S(2) σ) at 550 K. S(2) σ values are 8-fold higher than equivalent materials prepared using citric acid as a structure-directing agent, and electrical properties are comparable to the best-performing, extrinsically doped p-type polycrystalline tin selenides. The method offers an energy-efficient, rapid route to p-type SnSe nanostructures.

Introduction to Advances in Sustainable Hydrogen Energy.

Nader Karimi, Larry K. B. Li, Manosh C. Paul, Mohammad Hossein Doranehgard and Freshteh Sotoudeh introduce the RSC Advances themed issue on Advances in Sustainable Hydrogen Energy.

Effects of throat sizing and gasification agents in a biomass downdraft gasifier: towards CO2-free syngas production.

The gasification process in a downdraft biomass gasifier is investigated using Computational Fluid Dynamics (CFD). The aim is to develop a novel approach to reduce CO2 emissions from producer syngas while increasing the higher heating value (HHV). To this end, the effects of varying the throat diameter of the gasifier and gasifying media (air and oxygen) on the performance of gasification are investigated. The results reveal that as the throat ratio decreases for oxy-gasification, more CO, H2, and CH4 are produced, thus resulting in a HHV of 12.1 MJ Nm-3. For the same working conditions (ER, MC, and feedstock), the suggested design/optimum throat ratio of 0.14 is found to reduce CO2 by ∼55% compared to any other higher throat ratios, while simultaneously increasing HHV by ∼20% for both air and oxy-gasification cases. Additionally, the suggested throat ratio increases the gasification efficiency, carbon conversion and producer gas yield by 19%, 33%, and 22% respectively. Therefore, it shows a significant potential for CO2-free syngas production in the gasification process, demonstrating a promising technique that does not require any solvents, catalysts, absorbers, or additional CO2 removal. Lower throat ratios further favour the higher yield of syngas, HHV, gasification and conversion efficiencies, with better gasifier performance.

Life cycle assessment of waste-to-hydrogen systems for fuel cell electric buses in Glasgow, Scotland.

Waste-to-hydrogen (WtH) technologies are proposed as a dual-purpose method for simultaneous non-fossil-fuel based hydrogen production and sustainable waste management. This work applied the life cycle assessment approach to evaluate the carbon saving potential of two main WtH technologies (gasification and fermentation) in comparison to the conventional hydrogen production method of steam methane reforming (SMR) powering fuel cell electric buses in Glasgow. It was shown that WtH technologies could reduce CO2-eq emissions per kg H2 by 50-69% as compared to SMR. Gasification treating municipal solid waste and waste wood had global warming potentials of 4.99 and 4.11 kg CO2-eq/kg H2 respectively, which were lower than dark fermentation treating wet waste at 6.6 kg CO2-eq/kg H2 and combined dark and photo fermentation at 6.4 kg CO2-eq/kg H2. The distance emissions of WtH-based fuel cell electric bus scenarios were 0.33-0.44 kg CO2-eq/km as compared to 0.89 kg CO2-eq/km for the SMR-based scenario.

Simulation of haemodynamic flow in head and neck cancer chemotherapy.

BACKGROUND: In recent years, intra arterial chemotherapy has become an important component in head and neck cancer treatment. However, therapy success can vary significantly and consistent treatment guidelines are missing. The purpose of this study was to create a computer simulation of the chemical agent injection in the head and neck arteries to investigate the distribution and concentration of the chemical. METHODS: Realistic three dimensional patient specific geometry was created from image scan data. Pulsatile blood flow, turbulence, the chemical agent injection via a catheter, and the mixture between blood and the chemical were then simulated through the arterial network by computational fluid dynamics software. RESULTS: The results show a consistent chemical distribution throughout all the arteries and this is ineffective. In addition, due to high wall shear stress and turbulence at the inner bifurcation wall, serious complications during the treatment could occur, for instance haemolysis or thrombosis. CONCLUSIONS: The modelled catheter position is insufficient to provide a high chemical agent concentration in the desired tumour feeding artery, which is vital for therapy success.

Image-based computational fluid dynamics for estimating pressure drop and fractional flow reserve across iliac artery stenosis: A comparison with in-vivo measurements.

Computational Fluid Dynamics (CFD) and time-resolved phase-contrast magnetic resonance imaging (PC-MRI) are potential non-invasive methods for the assessment of the severity of arterial stenoses. Fractional flow reserve (FFR) is the current "gold standard" for determining stenosis severity in the coronary arteries but is an invasive method requiring insertion of a pressure wire. CFD derived FFR (vFFR) is an alternative to traditional catheter derived FFR now available commercially for coronary artery assessment, however, it can potentially be applied to a wider range of vulnerable vessels such as the iliac arteries. In this study CFD simulations are used to assess the ability of vFFR in predicting the stenosis severity in a patient with a stenosis of 77% area reduction (>50% diameter reduction) in the right iliac artery. Variations of vFFR, overall pressure drop and flow split between the vessels were observed by using different boundary conditions. Correlations between boundary condition parameters and resulting flow variables are presented. The study concludes that vFFR has good potential to characterise iliac artery stenotic disease.

Large-Eddy simulation of pulsatile blood flow.

Large-Eddy simulation (LES) is performed to study pulsatile blood flow through a 3D model of arterial stenosis. The model is chosen as a simple channel with a biological type stenosis formed on the top wall. A sinusoidal non-additive type pulsation is assumed at the inlet of the model to generate time dependent oscillating flow in the channel and the Reynolds number of 1200, based on the channel height and the bulk velocity, is chosen in the simulations. We investigate in detail the transition-to-turbulent phenomena of the non-additive pulsatile blood flow downstream of the stenosis. Results show that the high level of flow recirculation associated with complex patterns of transient blood flow have a significant contribution to the generation of the turbulent fluctuations found in the post-stenosis region. The importance of using LES in modelling pulsatile blood flow is also assessed in the paper through the prediction of its sub-grid scale contributions. In addition, some important results of the flow physics are achieved from the simulations, these are presented in the paper in terms of blood flow velocity, pressure distribution, vortices, shear stress, turbulent fluctuations and energy spectra, along with their importance to the relevant medical pathophysiology.

Rôle of contrast media viscosity in altering vessel wall shear stress and relation to the risk of contrast extravasations.

Iodinated contrast media (CM) are the most commonly used injectables in radiology today. A range of different media are commercially available, combining various physical and chemical characteristics (ionic state, osmolality, viscosity) and thus exhibiting distinct in vivo behaviour and safety profiles. In this paper, numerical simulations of blood flow with contrast media were conducted to investigate the effects of contrast viscosity on generated vessel wall shear stress and vessel wall pressure to elucidate any possible relation to extravasations. Five different types of contrast for Iodine fluxes ranging at 1.5-2.2gI/s were modelled through 18G and 20G cannulae placed in an ideal vein at two different orientation angles. Results demonstrate that the least viscous contrast media generate the least maximum wall shear stress as well as the lowest total pressure for the same flow rate. This supports the empirical clinical observations and hypothesis that more viscous contrast media are responsible for a higher percentage of contrast extravasations. In addition, results support the clinical hypothesis that a catheter tip directed obliquely to the vein wall always produces the highest maximum wall shear stress and total pressure due to impingement of the contrast jet on the vessel wall.

Pulsatile spiral blood flow through arterial stenosis.

Pulsatile spiral blood flow in a modelled three-dimensional arterial stenosis, with a 75% cross-sectional area reduction, is investigated by using numerical fluid dynamics. Two-equation k-ω model is used for the simulation of the transitional flow with Reynolds numbers 500 and 1000. It is found that the spiral component increases the static pressure in the vessel during the deceleration phase of the flow pulse. In addition, the spiral component reduces the turbulence intensity and wall shear stress found in the post-stenosis region of the vessel in the early stages of the flow pulse. Hence, the findings agree with the results of Stonebridge et al. (2004). In addition, the results of the effects of a spiral component on time-varying flow are presented and discussed along with the relevant pathological issues.

LES of additive and non-additive pulsatile flows in a model arterial stenosis.

Transition of additive and non-additive pulsatile flows through a simple 3D model of arterial stenosis is investigated by using a large eddy simulation (LES) technique. We find in both the pulsatile cases that the interaction of the two shear layers, one of which separates from the nose of the stenosis and the another one from its opposite wall, causes recirculation in the flow downstream of the stenosis where the nature of the transient flow becomes turbulent. The strength of this recirculation is found to be quite high from the non-additive pulsations when the flow Reynolds numbers, Re>or=1500, for which both the pressure and shearing stresses take on an oscillating form at the post-stenotic region. Potential medical consequences of these results are discussed in the paper. In addition, some comparisons of the non-additive pulsatile results are given with those of both the additive pulsatile and steady flows. The capability of using LES to simulate the pulsatile transitional flow is also assessed, and the present results show that the smaller (subgrid) scales (SGS) contributes about 78% energy dissipation to the flow when the Reynolds number is taken as 2000. The level of SGS dissipation decreases as the Reynolds number is decreased. The numerical results are validated with the experimental data available in literature where a quite good agreement is found.

Investigation of spiral blood flow in a model of arterial stenosis.

The spiral component of blood flow has both beneficial and detrimental effects in human circulatory system [Stonebridge PA, Brophy CM. Spiral laminar flow in arteries? Lancet 1991; 338: 1360-1]. We investigate the effects of the spiral blood flow in a model of three-dimensional arterial stenosis with a 75% cross-sectional area reduction at the centre by means of computational fluid dynamics (CFD) techniques. The standard k-omega model is employed for simulation of the blood flow for the Reynolds number of 500 and 1000. We find that for Re=500 the spiral component of the blood flow increases both the total pressure and velocity of the blood, and some significant differences are found between the wall shear stresses of the spiral and non-spiral induced flow downstream of the stenosis. The turbulent kinetic energy is reduced by the spiral flow as it induces the rotational stabilities in the forward flow. For Re=1000 the tangential component of the blood velocity is most influenced by the spiral speed, but the effect of the spiral flow on the centreline turbulent kinetic energy and shear stress is mild. The results of the effects of the spiral flow are discussed in the paper along with the relevant pathological issues.