Modelling the effect of the electrode potential on the metal-adsorbate surface states: relevant states in the charge transfer mechanism of SERS

Quantum mechanical calculations of the ground and excited electronic states of several [Ag(n)-pyridine](q) complexes yield a linear dependence of the energies of the surface states, especially the metal-to-molecule charge transfer states, on q(eff) = q/n. This is the first theoretical approach to modelling the effect of the electrode potential on SERS.     

Miniaturization through lab-on-a-chip: Utopia or reality for routine laboratories? A review

Micro total analysis (μTAS), also called “lab-on-a-chip (LOC)” technology, promises solutions for high throughput and highly specific analysis for chemistry, biology and medicine, while consuming only tiny amounts of samples, reactants and space. This article reports selected contributions of LOC, which represent clear practical approaches for routine work, or presenting potentiality to be transferred to routine analytical laboratories. Taking into account the present LOC state-of-the-art, we identify various reasons for its scarce implementation in routine analytical laboratories despite its high analytical potential, as well as the probably main “niche” for successfully practical developments is suggested.     

Helly Numbers of Polyominoes

We define the Helly number of a polyomino P as the smallest number h such that the h-Helly property holds for the family of symmetric and translated copies of P on the integer grid. We prove the following: (i) the only polyominoes with Helly number 2 are the rectangles, (ii) there does not exist any polyomino with Helly number 3, (iii) there exist polyominoes of Helly number k for any k ≠ 1, 3.     

Preliminary assessment of the performance of oyster shells and chitin materials as adsorbents in the removal of saxitoxin in aqueous solutions

ABSTRACT: BACKGROUND: This study evaluated the adsorption capacity of the natural materials chitin and oyster shell powder (OSP) in the removal of saxitoxin (STX) from water. Simplified reactors of adsorption were prepared containing 200 mg of adsorbents and known concentrations of STX in solutions with pH 5.0 or 7.0, and these solutions were incubated at 25 [DEGREE SIGN]C with an orbital shaker at 200 RPM. The adsorption isotherms were evaluated within 48 hours, with the results indicating a decrease in STX concentrations in different solutions (2[EN DASH]16 mug/L). The kinetics of adsorption was evaluated at different contact times (0[EN DASH]4320 min) with a decrease in STX concentrations (initial concentration of 10 mug/L). The sampling fractions were filtered through a membrane (0.20 mum) and analyzed with high performance liquid chromatography to quantify the STX concentration remaining in solution. RESULTS: Chitin and OSP were found to be efficient adsorbents with a high capacity to remove STX from aqueous solutions within the concentration limits evaluated (> 50 % over 18 h). The rate of STX removal for both adsorbents decreased with contact time, which was likely due to the saturation of the adsorbing sites and suggested that the adsorption occurred through ion exchange mechanisms. Our results also indicated that the adsorption equilibrium was influenced by pH and was not favored under acidic conditions. CONCLUSIONS: The results of this study demonstrate the possibility of using these two materials in the treatment of drinking water contaminated with STX. The characteristics of chitin and OSP were consistent with the classical adsorption models of linear and Freundlich isotherms. Kinetic and thermodynamic evaluations revealed that the adsorption process was spontaneous (DeltaGads < 0) and favorable and followed pseudo-second-order kinetics.     

Silicene: compelling experimental evidence for graphenelike two-dimensional silicon

Because of its unique physical properties, graphene, a 2D honeycomb arrangement of carbon atoms, has attracted tremendous attention. Silicene, the graphene equivalent for silicon, could follow this trend, opening new perspectives for applications, especially due to its compatibility with Si-based electronics. Silicene has been theoretically predicted as a buckled honeycomb arrangement of Si atoms and having an electronic dispersion resembling that of relativistic Dirac fermions. Here we provide compelling evidence, from both structural and electronic properties, for the synthesis of epitaxial silicene sheets on a silver (111) substrate, through the combination of scanning tunneling microscopy and angular-resolved photoemission spectroscopy in conjunction with calculations based on density functional theory.     

Coarse grained variables and deterministic chaos in an excitable system

Temporal coarse graining was applied to the dynamical variables of a semiconductor laser with optical feedback. The chaotic low frequency fluctuations obtained in numerical and experimental data are shown to have properties of a self-excitable deterministic system. External exciting noise is replaced by the ultrafast chaotic oscillations of the system. A low dimensional coarse-grained phase space is defined and time constants are introduced and measured for the exponential drop and recovery of the randomly excited equally shaped spikes.     

Measurement of the tt[over] production cross section in pp[over] collisions at sqrt(s)=1.96 TeV

We measure the tt[over] production cross section in pp[over] collisions at sqrt(s)=1.96 TeV in the lepton + jets channel. Two complementary methods discriminate between signal and background: b tagging and a kinematic likelihood discriminant. Based on 0.9 fb(-1) of data collected by the D0 detector at the Fermilab Tevatron Collider, we measure sigma(tt[over])=7.62+/-0.85 pb, assuming the current world average m(t)=172.6 GeV. We compare our cross section measurement with theory predictions to determine a value for the top-quark mass of 170+/-7 GeV.     

Comparison of the sensitivity of extraordinary transmittance peaks with the surrounding media for hole and slit arrays

In this paper we compare the sensitivity of the Extraordinary Transmittance (ET) peak position with the surrounding media for two types of metallic structures: arrays of holes and arrays of slits recorded in Au films. Both types of array were fabricated using Interference Lithography (IL) with a period of 700 nm and an Au thickness of 150 nm. The transmission spectra measurements were performed at normal incidence using a spectrophotometer. The results show that an array of slits presents a higher sensitivity for the surrounding media than the array of holes. Theoretical TE and TM simulations of the transmission spectra for the slit arrays agree very well with the experimental results, confirming the better sensitivity of the slit arrays.     

A mixed basis approach in the SGP-limit

A perturbation method for computing quick estimates of the echo decay in pulsed spin echo gradient NMR diffusion experiments in the short gradient pulse limit is presented. The perturbation basis involves (relatively few) dipole distributions on the boundaries generating a small perturbation matrix in O(s²) time, where s denotes the number of boundary elements. Several approximate eigenvalues and eigenfunctions to the diffusion operator are retrieved. The method is applied to 1D and 2D systems with Neumann boundary conditions.     

Hölder Continuity of Absolutely Continuous Spectral Measures for One-Frequency Schrödinger Operators

We establish sharp results on the modulus of continuity of the distribution of the spectral measure for one-frequency Schrödinger operators with Diophantine frequencies in the region of absolutely continuous spectrum. More precisely, we establish 1/2-Hölder continuity near almost reducible energies (an essential support of absolutely continuous spectrum). For non-perturbatively small potentials (and for the almost Mathieu operator with subcritical coupling), our results apply for all energies.