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Role of Electronic Curve Crossing of Benzene S-1 State in the Photodissociation of Aryl Halides, Effect of Fluorination: RASSI-SO MS-CASPT2 Study

An ab initio study of the role of electronic curve crossing of benzene S-1 state in the photo dissociation dynamics of the iodobenzene and effect of fluorination is presented. Two dissociative life times observed in iodobenzene is attributed to the coupled repulsive potential energy curves of the low-lying n-sigma*, pi-sigma*, pi-pi* states. The direct channel is attributed to the alkyl like trans

Spatiotemporal aspects of silica buffering in restored tidal marshes

Losses of pelagic diatom production resulting from silica limitation have not only been blamed for toxic algal blooms, but for the reduction in ability of coastal food webs to support higher trophic levels. Recent research has shown the importance of advective seepage water fluxes of dissolved silica (DSi) from freshwater marshes to pelagic waters during moments of riverine Si-limitation. In this

Functional markers of selenium status: UK Food Standards Agency workshop report

The workshop was organised to discuss the validity and limitations of existing functional markers of Se status in human subjects and to identify future research priorities in this area. Studies presented as part of this workshop investigated: the bioavailability of Se from different dietary sources; potential functional markers of Se status; individual variation in response to Se; the effect of ma

Doing ambivalence: Embracing policy innovation - At arm's length

This article considers the social organization of responses among human service staff to changes in public policy, using a study of a Swedish treatment center for juveniles as an illustration. The stance toward a new treatment ideology, "family-work," was not one of either accepting or rejecting the new policy; the staff conveyed both embracing and distancing. Policy innovations, it is argued, cre

Fluid flow in compressible porous media: I: Steady-state conditions

This is the first of two articles dealing with fluid flow in compressible porous media. In this article a model describing fluid flow and pressure-induced variations in porosity under stationary conditions is developed. In a forthcoming article the dynamic behavior during filtration and wet pressing of compressible porous media are presented. Fluid flow through rigid porous media is generally desc

The period of hypotension following orthostatic challenge is prolonged in dementia with Lewy bodies.

OBJECTIVES: To determine whether orthostatic hypotension (OH) is more common in patients with dementia than in older people without cognitive impairment and to identify key differences in the profile of the orthostatic response and the pulse drive during orthostatic challenge between Alzheimer's disease (AD) and dementia with Lewy bodies (DLB). METHODS: The orthostatic response was evaluated in 23

Pharmacokinetics and splenic accumulation of N-acetylamino-3-chloro-N-(2-diethylamino-ethyl) benzamide after a single administration to rats.

The purpose of this study was to measure the pharmacokinetics and tissue accumulation of N-acetylamino-3-chloro-N-(2-diethylamino-ethyl) benzamide (NACPA) after oral or intravenous administration at a single dose of 25 mg/kg to female W/Fu rats. The serum pharmacokinetics of NACPA were characterized by rapid absorption, distribution and elimination. However, in comparison with its parent compound,

Annoyance and performance during the experimental chemical challenge of subjects with multiple chemical sensitivity.

OBJECTIVES: This study explored the subjective reactions and psychological test performance of smell-intolerant subjects during consecutive challenges to chemicals with contrasting neurotoxic properties. METHODS: Women with symptoms compatible with multiple chemical sensitivity (N=10) and healthy referents (N=20) were individually challenged in an exposure chamber. All the subjects attended two se

Primary production of Inner Mongolia, China, between 1982 and 1999 estimated by a satellite data-driven light use efficiency model

Declining biological production as a part of an ongoing land degradation process is considered a severe environmental problem in the dry northern and northwestern regions of China. The aim of this study is to develop and adapt a satellite data-driven gross primary production model called Lund University light use efficiency model (LULUE) to temperate conditions in order to map gross primary produc

Projective linear groups as maximal symmetry groups

A maximal symmetry group is a group of isomorphisms of a three-dimensional hyperbolic manifold of maximal order in relation to the volume of the manifold. In this paper we determine all maximal symmetry groups of the types PSL(2, q) and PGL(2, q). Depending on the prime p there are one or two such groups with q=pk and k always equals 1, 2 or 4.

Separation of lactic acid-producing bacteria from fermentation broth using a ceramic microfiltration membrane with constant permeate flow

The influence of several operating parameters on the critical flux in the separation of lactic acid-producing bacteria from fermentation broth was studied using a ceramic microfiltration membrane equipped with a permeate pump. The operating parameters studied were crossflow velocity over the membrane, bacterial cell concentration, protein concentration, and pH. The influence of the isoelectric poi

Determining Critical Process Parameters and Process Robustness in Preparative Chromatography - A Model-Based Approach

This paper presents a model-based method to aid in the process validation for the purification of pharmaceutical drugs. The critical process parameters are identified by simulating process disturbances, and this information is then used to determine if the process control space is robust. Simulations are chosen to analyze the entire control space to also find nonlinearities and interaction effects

Value at Risk with time varying variance, skewness and kurtosis-the NIG-ACD model

A new model for financial returns with time varying variance, skewness and kurtosis based on the Normal Inverse Gaussian (NIG) distribution is proposed. The new model and two previously suggested NIG models are evaluated by their Value at Risk (VaR) forecasts on a long series of daily Standard and Poor's 500 returns. All three models perform very well compared with extant models and clearly outper

Adolescents with alpha1-antitrypsin deficiency have high alpha2-macroglobulin and low neutrophil lipocalin and elastase levels in plasma

Eighteen-year-old adolescents with alpha1-antitrypsin (alpha1AT) deficiency have mostly normal lung function tests. We hypothesized that compensatory increases in other protease inhibitors and/or a decreased leukocyte activity might favorably affect the protease/protease-inhibitor balance in alpha1AT-deficient adolescents. At the age of 18 y 46 PiZZ (severe deficiency), 22 PiSZ (moderate deficienc

Radiative lifetime measurements of even-parity levels of singly ionized erbium

Radiative lifetime measurements were performed by time-resolved laser-induced fluorescence (LIF) technique for eight even-parity levels of the astrophysically important ion Er+ over the energy range from 33753 to 55317 cm(-1). Free erbium ions were generated by a laser-induced plasma. A narrow bandwidth UV laser pulse (1 ns) was employed to populate selectively the short-lived upper levels, and th

An office procedure to detect vestibular loss in children with hearing impairment

As coexisting vestibular and cochlear lesions are of etiological importance, evaluation of children with congenital or early acquired hearing impairment (HI) should include vestibular assessment. A rotation test requires specific equipment and allows only detection of bilateral vestibular impairment. An impulse or head thrust test allows assessment of one ear at a time, detects more pronounced cal

The odour makes the difference: male moths attracted by sex pheromones ignore the threat by predatory bats

How animals adjust their foraging or mate finding behaviour according to the risk of predation has received much attention recently. However, few studies have focused on the behaviour of prey when stimuli representing different adaptive behaviours originate from different sensory modalities. Here we present data on how male moths trade off odour-mediated mate attraction and auditory-mediated preda

Efficient Broadcasting in Known Geometric Radio Networks with Non-uniform Ranges

We study here deterministic broadcasting in geometric radio networks (GRN) whose nodes have complete knowledge of the network. Nodes of a GRN are deployed in the Euclidean plane (R 2) and each of them can transmit within some range r assigned to it. We adopt model in which ranges of nodes are non-uniform and they are drawn from the predefined interval 0 ≤ r min ≤ r max . All our results are in the