Frequency and surface effects on the CESR of silver,sodium and copper

The effect of the observational frequency upon the Conduction Electron Spin Resonance recorded from silver foils and sodium in quartz tubes is reported. For both materials an increase in frequency results in an increase in linewidth, a linear relationship being indicated for silver. We interpret some features of the results as being due to surface effects, additional evidence for the influence of the surface on CESR coming from surface treatment of copper foils.     

A Nanocage for Nanomedicine: Polyhedral Oligomeric Silsesquioxane (POSS)

Ground‐breaking advances in nanomedicine (defined as the application of nanotechnology in medicine) have proposed novel therapeutics and diagnostics, which can potentially revolutionize current medical practice. Polyhedral oligomeric silsesquioxane (POSS) with a distinctive nanocage structure consisting of an inner inorganic framework of silicon and oxygen atoms, and an outer shell of organic functional groups is one of the most promising nanomaterials for medical applications. Enhanced biocompatibility and physicochemical (material bulk and surface) properties have resulted in the development of a wide range of nanocomposite POSS copolymers for biomedical applications, such as the development of biomedical devices, tissue engineering scaffolds, drug delivery systems, dental applications, and biological sensors. The application of POSS nanocomposites in combination with other nanostructures has also been investigated including silver nanoparticles and quantum dot nanocrystals. Chemical functionalization confers antimicrobial efficacy to POSS, and the use of polymer nanocomposites provides a biocompatible surface coating for quantum dot nanocrystals to enhance the efficacy of the materials for different biomedical and biotechnological applications. Interestingly, a family of POSS‐containing nanocomposite materials can be engineered either as completely non‐biodegradable materials or as biodegradable materials with tuneable degradation rates required for tissue engineering applications. These highly versatile POSS derivatives have created new horizons for the field of biomaterials research and beyond. Currently, the application of POSS‐containing polymers in various fields of nanomedicine is under intensive investigation with expectedly encouraging outcomes.

     

Efficient linear solvers for incompressible flow simulations using Scott‐Vogelius finite elements

Recent research has shown that in some practically relevant situations like multiphysics flows (Galvin et al., Comput Methods Appl Mech Eng, to appear) divergence‐free mixed finite elements may have a significantly smaller discretization error than standard nondivergence‐free mixed finite elements. To judge the overall performance of divergence‐free mixed finite elements, we investigate linear solvers for the saddle point linear systems arising in ((P_k)^d,P _k‐1^disc) Scott‐Vogelius finite element implementations of the incompressible Navier–Stokes equations. We investigate both direct and iterative solver methods. Due to discontinuous pressure elements in the case of Scott‐Vogelius (SV) elements, considerably more solver strategies seem to deliver promising results than in the case of standard mixed finite elements such as Taylor‐Hood elements. For direct methods, we extend recent preliminary work using sparse banded solvers on the penalty method formulation to finer meshes and discuss extensions. For iterative methods, we test augmented Lagrangian and \begin{align*}\mathcal{H}\end{align*} ‐LU preconditioners with GMRES, on both full and statically condensed systems. Several numerical experiments are provided that show these classes of solvers are well suited for use with SV elements and could deliver an interesting overall performance in several applications.© 2012 Wiley Periodicals, Inc. Numer Methods Partial Differential Eq, 2013     

Crystal structure of (4α,4aα,8aα)-(±)-octahydro-2-(phenylmethyl)-2H-1,2-benzoxazin-4-ol, 4-methylbenzenesulfonate(ester)

The title compound, a bicyclic tetrahydro-1,2-oxazine, crystallizes in a monoclinic lattice, space group P2₁/c, with a = 12.9809(18)Å, b = 12.920(2)Å, c = 13.631(2)Å, = 110.713(12)°, and Z = 4. The structure found in the solid state for this conformationally mobile molecule shows the tosyl group in an axial position and a benzyl group in an equatorial position of the bicyclic system.     

A practical volume algorithm

We present a practical algorithm for computing the volume of a convex body with a target relative accuracy parameter \(\varepsilon >0\). The convex body is given as the intersection of an explicit set of linear inequalities and an ellipsoid. The algorithm is inspired by the volume algorithms in Lovász and Vempala (J Comput Syst Sci 72(2):392–417, 2006) and Cousins and Vempala (SODA, pp. 1215–1228, 2014), but makes significant departures to improve performance, including the use of empirical convergence tests, an adaptive annealing scheme and a new rounding algorithm. We propose a benchmark of test bodies and present a detailed evaluation of our algorithm. Our results indicate that that volume computation and integration might now be practical in moderately high dimension (a few hundred) on commodity hardware.     

Secondary ion yields produced by keV atomic and polyatomic ion impacts on a self-assembled monolayer surface

A suite of keV polyatomic or 'cluster' projectiles was used to bombard unoxidized and oxidized self-assembled monolayer surfaces. Negative secondary ion yields, collected at the limit of single ion impacts, were measured and compared for both molecular and fragment ions. In contrast to targets that are orders of magnitude thicker than the penetration range of the primary ions, secondary ion yields from polyatomic projectile impacts on self-assembled monolayers show little to no enhancement when compared with monatomic projectiles at the same velocity. This unusual trend is most likely due to the structural arrangement and bonding characteristics of the monolayer molecules with the Au(111). Copyright 1999 John Wiley & Sons, Ltd.     

Three-Dimensional Lattice Boltzmann Simulations of Single-Phase Permeability in Random Fractal Porous Media with Rough Pore–Solid Interface

Single-phase permeability k has intensively been investigated over the past several decades by means of experiments, theories and simulations. Although the effect of surface roughness on fluid flow and permeability in single pores and fractures as well as networks of fractures was studied previously, its influence on permeability in a random mass fractal porous medium constructed of pores of different sizes remained as an open question. In this study, we, therefore, address the effect of pore–solid interface roughness on single-phase flow in random fractal porous media. For this purpose, we apply a mass fractal model to construct porous media with a priori known mass fractal dimensions \(2.579 \le D_{\mathrm{m}} \le 2.893\) characterizing both solid matrix and pore space. The pore–solid interface of the media is accordingly roughened using the Weierstrass–Mandelbrot approach and two parameters, i.e., surface fractal dimension \(D_{\mathrm{s}}\) and root-mean-square (rms) roughness height. A single-relaxation-time lattice Boltzmann method is applied to simulate single-phase permeability in the corresponding porous media. Results indicate that permeability decreases sharply with increasing \(D_{\mathrm{s}}\) from 1 to 1.1 regardless of \(D_{\mathrm{m}}\) value, while k may slightly increase or decrease, depending on \(D_{\mathrm{m}}\), as \(D_{\mathrm{s}}\) increases from 1.1 to 1.6.     

Fusion around the barrier for 7Li+12C

Fusion cross-sections for the ⁷Li + ¹²C reaction have been measured at energies above the Coulomb barrier by the direct detection of evaporation residues. The heavy evaporation residues with energies below 3 MeV could not be separated out from the α-particles in the spectrum and hence their contribution was estimated using statistical model calculations. The present work indicates that suppression of fusion cross-sections due to the breakup of ⁷Li may not be significant for ⁷Li + ¹²C reaction at energies around the barrier.     

Synthethesis of 4-alkyl-3,5-diamino-l,2,4,6-thiatriazine l,l-dioxides. Part II

4-Alkyl-l,2,4,6-thiatriazine-l-oxides and dioxides have been prepared using a variety of new methods and their structures determined by ¹³C nmr analysis.