A comparative photophysical and photochemical study of nitropyrene isomers occurring in the environment

Ground state absorption, first excited-singlet state, and properties of reactive intermediates of mononitropyrene isomers encountered in the atmospheric aerosol have been studied under different conditions that could mimic the environment. The nitro group can present different orientations relative to the pyrene ring depending on its geometric location and could induce differences in the photochemistry of the isomers. The 2-NO(2)Py isomer has the largest red shift and lowest oscillator strength in the UV-visible band associated with the nitro group. The isomers show very low fluorescence yields (10(-3)-10(-4)). Only 1-NO(2)Py and 4-NO(2)Py have phosphorescence emission (Φ(p) ≈ 10(-4)), indicating that the lowest triplet state decays mainly through effective radiationless channels. Laser photolysis produces a low-lying triplet state (τ(T) = 10(-5)-10(-6) s), a long-lived pyrenoxy radical, and a PyNO(2)H radical in solvents in which the triplet can abstract a hydrogen atom. Similar triplet yields were calculated (0.1-0.6) for the isomers, while significant differences in the relative yield of the long-lived species were determined. Differences in the quenching rate constants of the triplet by water and phenols suggest a strong hydrogen-bond interaction with the nitro group in the C-2 position, which provides for radiationless deactivation routes.     

Stability analysis of implicit time discretizations for the Compton-scattering Fokker–Planck equation

The Fokker–Planck equation is a widely used approximation for modeling the Compton scattering of photons in high energy density applications. In this paper, we perform a stability analysis of three implicit time discretizations for the Compton-Scattering Fokker–Planck equation. Specifically, we examine (i) a Semi-Implicit (SI) scheme that employs backward-Euler differencing but evaluates temperature-dependent coefficients at their beginning-of-time-step values, (ii) a Fully Implicit (FI) discretization that instead evaluates temperature-dependent coefficients at their end-of-time-step values, and (iii) a Linearized Implicit (LI) scheme, which is developed by linearizing the temperature dependence of the FI discretization within each time step. Our stability analysis shows that the FI and LI schemes are unconditionally stable and cannot generate oscillatory solutions regardless of time-step size, whereas the SI discretization can suffer from instabilities and nonphysical oscillations for sufficiently large time steps. With the results of this analysis, we present time-step limits for the SI scheme that prevent undesirable behavior. We test the validity of our stability analysis and time-step limits with a set of numerical examples.     

Three-dimensional coronary artery MR imaging using prospective real-time respiratory navigator and linear phase shift processing: comparison with conventional coronary angiography.

Respiratory gating with navigator echo is a recent technique to detect diaphragm position in 3D magnetic resonance (MR) coronary angiography. The purpose of our study was to image proximal coronary arteries and to detect significant stenoses in patients with coronary artery diseases and to compare with contrast enhanced angiography results. Twenty patients with coronary artery diseases who were referred for conventional angiography underwent magnetic resonance angiography (MRA). Three-dimensional gradient echo volumes were acquired using cardiac and respiratory gating and fat suppression. Using reformatted oblique planes and maximum intensity projection technique, visualization coronary segments and detection of significant coronary stenoses were made. Eighty-three coronary segments were analyzed. The sensitivity and specificity were 65% and 93%, respectively. The corresponding positive and negative predictive values were 69% and 91%. This study shows the ability to image correctly coronary arteries and to identify proximal stenoses, but image quality need to be improved for an efficiency detection of coronary artery stenoses in clinical practice.     

Electric quadrupole moment of the neutron-rich 33Al

The nuclear electric quadrupole moment (Q moment) of the neutron-rich nucleus ³³Al (I = 5/2 , T _1/2 = 41 ms) has been measured by the $ \beta$ -ray detected nuclear quadrupole resonance ( $ \beta$ -NQR) method for the first time. The ³³Al nucleus is considered to be on the border of the island of inversion within which a significant intrusion of the pf orbits occurs across the N = 20 shell gap and the intrusion causes an anomalous enhancement of the Q moment. Polarized ³³Al nuclei were produced from ³⁶S (77.5MeV/u beams through the fragmentation process and separated by LISE fragment separator at GANIL. The ³³Al nuclei were implanted into a Al₂O₃ single-crystal plate and the $ \beta$ -NQR spectrum was successfully obtained.     

How to extract QCD baryons from a lattice theory with staggered fermions

The explicit form of the correlation function for the most general local baryon operators is obtained for staggered fermions, in the center of mass. From the discrete symmetries of the action, it is shown that all operators couple to spin-$\text{1}\text{2}$ states only. The whole physical information coming from any numerical simulation, including parity assignments, can be extracted from only one real function of the lattice time. All other correlation functions which can be measured vanish in the limit of large samples of gauge configurations, which may be used as a measure of the statistical significance of data.     

Interactions solutés-solvants en milleu eau-alcool tert-butylique: Partie II. Enthalpies de transfert de quelques acides carboxyliques

Solution enthalpies of acetic, propionic and isobutyric acid in water and in mixtures of water and t-butylalcohol are drawn from calorimetric measurements. For those three acids, enthalpies of transfer from water to the hydroorganic solvents exhibit a maximum for a particular composition of the solvents. These results are discussed in terms of structure of the hydroalcoholic media and of structure-breaking and -making abilities of the solutes.