Thermal expansion of supported and freestanding graphene: lattice constant versus interatomic distance

By using ab initio molecular dynamics calculations, we show that even where the graphene lattice constant contracts, as previously reported for freestanding graphene below room temperature, the average carbon-carbon distance increases with temperature, in both free and supported graphene. This results in a larger corrugation at higher temperature, which can affect the interaction between graphene and the supporting substrate. For a weakly interacting system as graphene/Ir(111), we confirm the results using an experimental approach which gives direct access to interatomic distances.     

FIXED POINT RESULTS ON METRIC-TYPE SPACES

In this paper we obtain fixed point and common fixed point theorems for self- mappings defined on a metric-type space, an ordered metric-type space or a normal cone metric space. Moreover, some examples and an application to integral equations are given to illustrate the usability of the obtained results.     

On a New Class of Systems of Generalized Quasi-Variational Inequalities

We introduce new types of systems of generalized quasi-variational inequalities and we prove the existence of the solutions by using results of pair equilibrium existence for free abstract economies. We consider the fuzzy models and we also introduce the random free abstract economy and the random equilibrium pair. The existence of the solutions for the systems of quasi-variational inequalities comes as consequences of the existence of equilibrium pairs for the considered free abstract economies.     

Deformations of permutation representations of Coxeter groups

The permutation representation afforded by a Coxeter group W acting on the cosets of a standard parabolic subgroup inherits many nice properties from W such as a shellable Bruhat order and a flat deformation over ?[q] to a representation of the corresponding Hecke algebra. In this paper we define a larger class of “quasiparabolic” subgroups (more generally, quasiparabolic W-sets), and show that they also inherit these properties. Our motivating example is the action of the symmetric group on fixed-point-free involutions by conjugation.     

Synthesis and sensing properties of zirconium-doped hematite nanoparticles

Zirconium-doped hematite particles of the type xZrO₂-(1−x)α-Fe₂O₃ (x=0.1, 0.5) were synthesized using mechanochemical activation and characterized by X-ray diffraction (XRD) and Mössbauer spectroscopy. For x=0.1 all zirconia was dissolved in the hematite lattice after 12 h of ball milling and a particle size of 9 nm was obtained. We obtained the recoilless fraction as function of the ball milling time for each value of the molar concentration x. The appearance of nanoparticles in the system was demonstrated based on these plots. We further correlated the structural properties of the zirconium-doped hematite system with the sensing properties of the best candidate in the series. These were measured as function of temperature, gas concentration (carbon monoxide and methane) and variable humidity of air. The material system was found to be sensitive over the entire range of CO concentrations and the linearity of the sensor signal was not affected by the relative humidity of air, qualities which make it the ideal system for gas sensing.     

Elastic scattering of neutrons on natPb at forward angles

Angular distributions were measured for neutron elastically scattered by ^natPb at 2.9, 3.0, 3.1, 3.2 and 3.4MeV at very forward angles. The mono-energetic neutron flux was produced at the tandem accelerator facility of the National Institute of Nuclear Research (ININ), Mexico, using the Associated Particle Technique (APT) in the D(d, n)³He reaction. Optical model predictions with best potential systematic show a fairly good agreement with our data, and also the need for a better understanding of the neutron scattering process at very small angles from the theoretical point of view.     

New 2-substituted 4-hydroxy-2H-1,2-benzothiazine-3-carboxamide 1,1-dioxides: Spectral and pharmacological properties

A series of 4-hydroxy-2H-1,2-benzothiazme-3-carboxamide 1,1-dioxides substituted on the sulfonamide nitrogen with ethoxycarbonylalkyl, cyanoalkyl and dialkylaminoalkyl groups was synthesized. Spectroscopic properties of the obtained products were analyzed. Findings from the pharmacological study of some of the compounds as antiinflammatory and analgesic agents are reported.     

Discontinuous Galerkin methods for the Navier–Stokes equations using solenoidal approximations

An interior penalty method and a compact discontinuous Galerkin method are proposed and compared for the solution of the steady incompressible Navier–Stokes equations. Both compact formulations can be easily applied using high‐order piecewise divergence‐free approximations, leading to two uncoupled problems: one associated with velocity and hybrid pressure, and the other one only concerned with the computation of pressures in the elements interior. Numerical examples compare the efficiency and the accuracy of both proposed methods. Copyright © 2009 John Wiley & Sons, Ltd.     

Existence of the Equilibrium in Choice

In this paper, we prove the existence of the equilibrium in choice for games in choice form. Thus, we add to the research recently appeared in the scientific literature. In fact, our results link the most recent research to the older approaches of the games in normal-form and the qualitative games.     

Comparison of two types of vertically aligned ZnO NRs for highly efficient polymer solar cells

Vertically aligned ZnO nanorods (NR) are prepared by two different syntheses methods and applied on polymer solar cells (PSCs). The ZnO electrodes work as the electron transport layer with the P3HT:PCBM blend acting as the active material. Several organic blend solution conditions are optimized: concentration, solvent, and deposition speed. The effect of different NR electrode morphologies is analyzed on the solar cell performance and characterized by current–voltage curves and IPCE analyses. The photovoltaic performance of the solar cells was observed to be influenced by many factors, among them infiltration of the organic P3HT:PCBM blend within the ZnO NR layer. The infiltration of the active layer was monitored by cross section SEM and energy dispersive X-ray spectroscopy analyses. Our results show that higher power conversion efficiencies are achieved when shorter NRs lengths are applied. The best power conversion efficiency obtained was 2.0% for a 400 nm ZnO NR electrode. © 2012 Wiley Periodicals, Inc. J Polym Sci Part B: Polym Phys, 2013