Win X-ray: a new Monte Carlo program that computes X-ray spectra obtained with a scanning electron microscope.

A new Monte Carlo program, Win X-ray, is presented that predicts X-ray spectra measured with an energy dispersive spectrometer (EDS) attached to a scanning electron microscope (SEM) operating between 10 and 40 keV. All the underlying equations of the Monte Carlo simulation model are included. By simulating X-ray spectra, it is possible to establish the optimum conditions to perform a specific analysis as well as establish detection limits or explore possible peak overlaps. Examples of simulations are also presented to demonstrate the utility of this new program. Although this article concentrates on the simulation of spectra obtained from what are considered conventional thick samples routinely explored by conventional microanalysis techniques, its real power will be in future refinements to address the analysis of sample classifications that include rough surfaces, fine structures, thin films, and inclined surfaces because many of these can be best characterized by Monte Carlo methods. The first step, however, is to develop, refine, and validate a viable Monte Carlo program for simulating spectra from conventional samples.     

Excavations in molecular crystals

Single crystals built from porous molecular networks can react with agents that penetrate the crystals, cleave fragments from the network, and thereby increase the volume available for guests, all without loss of crystallinity.     

Initial Measurements of Plasma Potential in the Core of the MST Reversed Field Pinch with a Heavy Ion Beam Probe

Measurement of the plasma potential in the core of MST marks both the first interior potential measurements in an RFP, as well as the first measurements by a Heavy Ion Beam Probe (HIBP) in an RFP. The HIBP has operated with (20-110) keV sodium beams in plasmas with toroidal currents of (200-480) kA over a wide range of densities and magnetic equilibrium conditions. A positive plasma potential is measured in the core, consistent with the expectation of rapid electron transport by magnetic fluctuations and the formation of an outwardly directed ambipolar radial electric field. Comparison between the radial electric field and plasma flow is underway to determine the extent to which equilibrium flow is governed by E×B. Measurements of potential and density fluctuations are also in progress.Unlike HIBP applications in tokamak plasmas, the beam trajectories in MST (RFP) are both three-dimensional and temporally dynamic with magnetic equilibrium changes associated with sawteeth. This complication offers new opportunity for magnetic measurements via the Heavy Ion Beam Probe (HIBP). The ion orbit trajectories are included in a Grad-Shafranov toroidal equilibrium reconstruction, helping to measure the internal magnetic field and current profiles. Such reconstructions are essential to identifying the beam sample volume locations, and they are vital in MST's mission to suppress MHD tearing modes using current profile control techniques. Measurement of the electric field may be accomplished by combining single point measurements from multiple discharges, or by varying the injection angle of the beam during single discharges.The application of an HIBP on MST has posed challenges resulting in additional diagnostic advances. The requirement to keep ports small to avoid introducing magnetic field perturbations has led to the design and successful implementation of cross-over sweep systems. High levels of ultraviolet radiation are driving alternative methods of sweep plate operation. While, substantial levels of plasma flux into the HIBP diagnostic chambers has led to the use of magnetic plasma suppression.     

A Functional Analytic Approach to Perturbations of the Lorentz Gas

We present a functional analytic framework based on the spectrum of the transfer operator to study billiard maps associated with perturbations of the periodic Lorentz gas. We show that recently constructed Banach spaces for the billiard map of the classical Lorentz gas are flexible enough to admit a wide variety of perturbations, including: movements and deformations of scatterers; billiards subject to external forces; nonelastic reflections with kicks and slips at the boundaries of the scatterers; and random perturbations comprised of these and possibly other classes of maps. The spectra and spectral projections of the transfer operators are shown to vary continuously with such perturbations so that the spectral gap enjoyed by the classical billiard persists and important limit theorems follow.     

A note on the square root law for urban police travel times

The classical Square Root Law formula for emergency travel times consists of one observable component, the density of patrol coverage, and one unknown component that must be estimated empirically, the effective travel speed. The effective travel speed is typically assumed to be an empirical constant. We test whether this simplifying assumption is justified empirically. We propose a modern machine-learning approach and a Least Absolute Shrinkage and Selection Operator regression to incorporate into a travel speed model various exogenous factors such as call type, incident location, weather conditions and traffic congestion. The value of the proposed analytical approach and some practical implications are demonstrated using operational data from a large urban police jurisdiction based in British Columbia, Canada. Although the analysis is framed within the context of urban emergency police operations, the proposed approach has the potential to be useful for other emergency services or roving business units that deal with unscheduled service calls.     

Ecotoxicological effects of combined UVB and organic contaminants in coastal waters: A review

Organisms living in coastal waters are exposed to anthropogenic contaminants from terrestrial drainage, ice melting and maritime traffic and to enhanced UVB radiation (UVBR; 280-320 nm) caused by decreased concentrations of ozone in the stratosphere. This article reviews available information about the combined effects of UVBR and selected hydrosoluble contaminants potentially present in surface waters on marine species and especially on plankton community structure in high-latitude coastal zones. Effects of UVBR on three selected pesticides (Atrazine, carbaryl and Acifluorfen) and possible induction of phototoxicity are reviewed. Most toxicological studies have been conducted under laboratory conditions with questionable relevance for coastal marine ecosystems. Similarly, photoactivation of polycyclic aromatic hydrocarbons (PAHs) has been closely examined and reported effects on aquatic species summarized. Experiments with field-sampled communities demonstrated the complexity and the difficulty in determining the impact of multiple stressors on an aquatic ecosystem, even for ecosystems simplified by eliminating large grazers and fish. Nutrient status, specific composition and light history have influenced the different responses of planktonic assemblages exposed to enhanced UVBR and water-soluble fraction (WSF) from crude oil or to tributyltin. Plankton assemblages subjected to changes in the ozone hole were physiologically stressed and more susceptible to WSF toxicity than communities from less enhanced UVBR-impacted sites. A close relationship between phytoplankton assemblages and bacteria was observed in all experiments in mesocosms. A contaminant-induced phytoplankton crash after a bloom event may release important carbon and nutrient sources for bacteria. The magnitude of phytoplanktonic mortality induced by a contaminant probably influenced how rapidly bacteria grew over time. The transition from a herbivorous food web to a microbial food web has significant ecological implications for carbon cycling and energy flow in pelagic systems. A high phytoplankton mortality implies a situation in which the potential for downward carbon export from surface waters is high. In contrast, high bacterial enrichment implies that the phytoplankton carbon is largely recycled in surface waters through a microbial loop and does not contribute significantly to sinking particle flux. The most ecologically relevant results were obtained with mesocosm studies using field-collected communities. The enhancement of hydrocarbon toxicity in the presence of a high level of UVBR cannot be described as being a synergistic or an additive effect, because the WSF alone is not toxic and may even be beneficial by increasing bacterial activity. This is a case in which one stressor has the ability to modify another stressor to cause it to be toxic to target organisms. These abiotically induced interactions may be important for biological communities exposed to extreme conditions when physical, chemical or photochemical reactions modify the nature of environmental stressors before they interact with biological functions. The need for models on the impacts of multiple stressors on biodiversity and ecosystem functioning is emphasized.     

Ultraviolet-B radiation effects on the structure and function of lower trophic levels of the marine planktonic food web

The impact of UV-B radiation (UVBR; 280-320 nm) on lower levels of a natural plankton assemblage (bacteria, phytoplankton and microzooplankton) from the St. Lawrence Estuary was studied during 9 days using several immersed outdoor mesocosms. Two exposure treatments were used in triplicate mesocosms: natural UVBR (N treatment, considered as the control treatment) and lamp-enhanced UVBR (H treatment, simulating 60% depletion of the ozone layer). A phytoplankton bloom developed after day 3, but no significant differences were found between treatments during the entire experiment for phytoplankton biomass (chlorophyll a and cell carbon) nor for phytoplankton cell abundances from flow cytometry and optical microscopy of three phytoplankton size classes (picoplankton, nanoplankton and microplankton). In contrast, bacterial abundances showed significantly higher values in the H treatment, attributed to a decrease in predation pressure due to a dramatic reduction in ciliate biomass (approximately 70-80%) in the H treatment relative to the N treatment. The most abundant ciliate species were Strombidinium sp., Prorodon ovum and Tintinnopsis sp.; all showed significantly lower abundances under the H treatment. P. ovum was the less-affected species (50% reduction in the H treatment compared with that of the N control), contrasting with approximately 90% for the other ones. Total specific phytoplanktonic and bacterial production were not affected by enhanced UVBR. However, both the ratio of primary to bacterial biomass and production decreased markedly under the H treatment. In contrast, the ratio of phytoplankton to bacterial plus ciliate carbon biomass showed an opposite trend than the previous results, with higher values in the H treatment at the end of the experiment. These results are explained by the changes in the ciliate biomass and suggest that UVBR can alter the structure of the lower levels of the planktonic community by selectively affecting key species. On the other hand, linearity between particulate organic carbon (POC) and estimated planktonic carbon was lost during the postbloom period in both treatments. On the basis of previous studies, our results can be attributed to the aggregation of carbon released by cells to the water column in the form of transparent exopolymer particles (TEPs) under nutrient limiting conditions. Unexpectedly, POC during such a period was higher in the H treatment than in controls. We hypothesize a decrease in the ingestion of TEPs by ciliates, in coincidence with increased DOC release by phytoplankton cells under enhanced UVBR. The consequences of such results for the carbon cycle in the ocean are discussed.     

Lewis base mediated autoionization of GeCl2 and SnCl2

Cationic and anionic species of heavier low-valent group 14 elements are intriguing targets in main group chemistry due to their synthetic potential and industrial applications. In the present study, we describe the synthesis of cationic (MCl(+)) and anionic (MCl(3)(-)) species of heavier low-valent group 14 elements of germanium(II) and tin(II) by using the substituted Schiff base 2,6-diacetylpyridinebis(2,6-diisopropylanil) as Lewis base (LB). Treatment of LB with 2 equiv of GeCl(2)·dioxane and SnCl(2) in toluene gives compounds [(LB)Ge(II)Cl](+)[Ge(II)Cl(3)](-) (1) and [(LB)Sn(II)Cl](+)[Sn(II)Cl(3)](-) (2), respectively, which possess each a low-valent cation and an anion. Compounds 1 and 2 are well characterized with various spectroscopic methods and single crystal X-ray structural analysis.