Partial least-squares regression and fuzzy clustering — A joint approach

Chemical and physical analyses of malt, the main ingredient of beer, have been used to predict the concentration of certain volatile compounds in the finished beer.The prediction was done by means of the partial least squares regression (PLS2) in SIMCA. The total data set as well as individual malt clusters were submitted to PLS analysis. Best prediction was obtained by separating the total object matrix in classes according to similarity found by fuzzy pattern recognition (FCV). FCV was also used to separate the beer variables in classes and to select the subset of variables to be predicted.A joint approach of fuzzy pattern recognition to identify groups of samples and SIMCA-PLS2 to predict several dependent variables is suggested as a powerful tool in process-analytical chemistry.     

Collective and two-quasiparticle states in 158Gd observed through study of radiative neutron capture in 157Gd

The level structure of ¹⁵⁸Gd has been studied using the prompt γ-rays and conversion electrons emitted following neutron capture in ¹⁵⁷Gd. The γ-ray energy and intensity measurements were made using both Ge(Li) detectors and a curved-crystal spectrometer. Conversion-electron energy and intensity measurements were made using two separate magnetic spectrometers: one to measure the primary electron spectrum and the other to measure the lower energy secondary electron spectrum. Some γ-γ coincidence measurements were also made among the secondary γ-rays. From these data, a neutron separation energy of 7937.1 ± 0.5 keV has been determined for ¹⁵⁸Gd. A level scheme containing 59 excited states with energies < 2.25 MeV, for which de-excitation modes have been identified, is proposed for ¹⁵⁸Gd. Many of these states have been grouped into rotational bands. A total of thirteen excited rotational bands with band-head energies below 2.0 MeV are contained in the level scheme. Features of the proposed level scheme include: the K^π = 0^?, 1^? and 2^? octupole-vibrational bands with band-head energies of 1263, 977 and 1793 keV, respectively; the γ-vibrational band at 1187 keV; three excited K^π = 0⁺ bands with band-head energies of 1196, 1452 and 1743 keV; several two-quasiparticle bands with band-head energies in keV (and K^π assignments) of 1380 (4⁺), 1636 (4^?), 1847 (1⁺), 1856 (1^?), 1920 (4⁺) and 1930 (1⁺). An analysis of (d, p) reaction data is presented which permits definite two-quasiparticle configuration assignments to be made to most of these latter bands. Evidence is presented which suggests strong mixing of some two-neutron and two-proton bands. A phenomenological four-band mixing analysis is made of the energy and E2 transition-probability data for the ground-state band and the three lowest-lying excited collective positive-parity bands. Good agreement with experiment is obtained. A Coriolis-mixing analysis of the octupole bands has been carried out and good agreement with the data on level energies and E1 transition probabilities to the ground-state band has been achieved. Values of Z, the ratio of the E1 transition matrix element with ΔK = 1 to that with ΔK = 0, involving the octupole bands and the first four 0⁺ bands are derived. For three of these 0⁺ bands, absolute values of these matrix elements are deduced. An interesting alternation in the sign of Z is observed for these four 0⁺ bands.     

The study of the (n, α) and (n, γ α) reactions on143Nd

Partial cross sections have been measured for the¹⁴³Nd(n _th,α)¹⁴⁰Ce reaction and also for the two-step process¹⁴³Nd(n _th,γα)¹⁴⁰Ce. The results of the present work confirm previous data, but due to lower background, better statistics and resolution improved precision has been obtained. The double-humped structure in the observed (n, γ α) spectrum can still be explained through the Porter-Thomas fluctuations of the reduced partialγ andα widths.     

Limits for axion emission in nuclear deexcitation processes

Abstract The question of the emission of pseudoscalar bosons (axions) in nuclear deexcitation processes and their decay into two photons was studied with a rotatable multi detector system at the power reactor Biblis A. Assuming an axion mass of 250 keV and the standard model decay rate we obtain (1.0 ± 1.0) × 1O^?10 for the ratio of the numbers of axions and Ml γ- ray transitions in the reactor core. This is ～ 10^?5 of the model prediction.     

Gammaübergänge und Energieniveaus in Dy 165

220 neutron capture Gamma rays of Dy 165 were measured with the Risø curved crystal spectrometer. The intense transitions permitted the construction of a level scheme for this oddN nucleus. The rotational bandsK=7/2⁺[633],K=1/2^?[521] andK=5/2^?[512] were precisely localized, including the spin 11/2 states. Gammavibrational bands built on these Nilsson orbits were observed with their band heads at 538.6, 573.5 and 570.2 keV. TheI=5/2 term at 533 keV can be considered as the 5/2^?[523] Nilsson state. The branching ratios allowed the determination of (g _K?g^R)²-factors for the [633], [521] and [512] bands and yieldedE 1-hindrance factors.     

The GEISA spectroscopic database: Current and future archive for Earth and planetary atmosphere studies

The development of Gestion et Etude des Informations Spectroscopiques Atmosphériques (GEISA: Management and Study of Spectroscopic Information) was started over three decades at Laboratoire de Météorologie Dynamique (LMD) in France. GEISA is a computer accessible spectroscopic database, designed to facilitate accurate forward radiative transfer calculations using a line-by-line and layer-by-layer approach. More than 350 users have been registered for on-line use of the GEISA facilities. The current 2003 edition of GEISA (GEISA-03) is a system comprising three independent sub-databases devoted respectively to: line transition parameters, infrared and ultraviolet/visible absorption cross-sections, microphysical and optical properties of atmospheric aerosols.Currently, GEISA is involved in activities related to the assessment of the capabilities of IASI (Infrared Atmospheric Sounding Interferometer on board of the METOP European satellite) through the GEISA/IASI database derived from GEISA.The GEISA-03 content is presented, placing emphasis on molecular species of interest for Earth and planetary atmosphere studies, with details on the updated 2008 archive underway. A critical assessment on the needs, in terms of molecular parameters archive, related with recent satellite astrophysical missions is made. Detailed information on free on-line GEISA and GEISA/IASI access is given at http://ara.lmd.polytechnique.fr and http://ether.ipsl.jussieu.fr.     

Straightforward α‐Amino Nitrile Synthesis Through Mo(CO)6‐Catalyzed Reductive Functionalization of Carboxamides

The selective reduction of amides into an intermediate hemiaminal catalyzed by Mo(CO)₆ together with the inexpensive and easy to handle TMDS (1,1,3,3‐tetramethyldisiloxane) as reducing agent, followed by subsequent trapping of the hemiaminal with a cyanide source, allows for the straightforward synthesis of α‐amino nitriles. The methodology presented here, displays high levels of chemoselectivity allowing for the reduction of amides in the presence of functional groups such as ketones, imines, aldehydes, and acids, which affords a simple route for the synthesis of α‐amino nitriles with a broad scope of functionalities in high yields. Furthermore, the applicability of this methodology is demonstrated by scale up experiments and by derivatization of the target compounds into synthetically interesting products. The selective cyanation is successfully applied in late stage functionalizations of amide containing drugs and prolinol derivatives.     

Trends in UV irradiance of tanning devices in Norway: 1983-2005

Abstract Indoor tanning increases skin cancer risk, but the importance of different parts of the UV spectrum is unclear. We assessed irradiance of tanning devices in Norway for the period 1983-2005. Since 1983, all tanning models needed approval before being sold or used. UV Type 3 limits were valid from late 1992 (<0.15 W m(-2) for CIE-weighted, i.e. erythemally weighted, short and long wave irradiances). We analyzed data from 90% of the approved tanning models (n = 446 models) and two large inspection surveys in 1998/1999 and 2003 (n = 1341 tanning devices). Mean CIE-weighted short wave irradiance of approved models increased from 0.050 W m(-2) (95% confidence interval [CI] 0.045-0.055) in 1983-1992 to 0.101 W m(-2) (95% CI 0.098-0.105) in 1993-2005, and mean long wave from 0.091 W m(-2) (95% CI 0.088-0.095) to 0.112 W m(-2) (95% CI 0.109-0.115), respectively. Inspection surveys revealed short wave irradiances much higher than that approved. In 1998-1999, only 28% (293/1034) of the devices were equipped with correct sunlamps and only 1 out of 130 inspected establishments fulfilled all requirements. In 2003, corresponding numbers were 59% (180/307) of devices and 2 out of 52 establishments. Mean short and long wave irradiances of the inspected tanning devices in 2003 were 1.5 and 3.5 times, respectively, higher than the irradiance of natural summer sun in Oslo. In conclusion, the short wave irradiance has increased in indoor tanning devices in Norway over the last 20 years. Due to the high long wave irradiance throughout this period, the percentage of short wave irradiance was much lower than for natural sun.