High-resolution Fourier-transform absorption spectra of nitrous acid (HONO) were recorded in the 400-700 cm−1 spectral region. For the trans-HONO isomer a very extensive analysis of the ν5 (ONO bend) and ν6 (torsion) interacting fundamental bands of trans-HONO located near 595.620 and 543.879 cm−1, respectively, was performed starting from the results of a previous study [C.M. Deeley, I.M. Mills, L.O. Halonen, J. Kauppinen, Can. J. Phys. 63 (1985) 962-965]. In addition, for the less abundant cis-HONO isomer, the first high-resolution study of the ν6 band located at 639.7432 cm−1 was achieved, the ν5 band is presumed to be located near 609.2 cm−1. For both isomers the strong A-type and B-type Coriolis interactions linking the {51, 61} interacting energy levels were accounted for during the energy level calculations. Finally, using these results a list of positions and of realistic relative line intensities has been generated for both isomers, and a comparison with some ab initio predictions was performed. 相似文献
Fluorobenzoyl groups have been investigated as alternatives to acetyl and benzoyl protective groups in carbohydrate and glycopeptide synthesis. D-Glucose and lactose were protected with different fluorobenzoyl groups and then converted into glycosyl bromides in high yields (>80% over two steps). Glycosylation of protected derivatives of serine with these donors gave 1,2-trans glycosides in good yields (approximately 60--70%) and excellent stereoselectivity without formation of ortho esters. The resulting glycosylated amino acid building blocks were then used in solid-phase synthesis of two model O-linked glycopeptides known to be unusually sensitive to beta-elimination on base-catalyzed deacylation. When either a 3-fluoro- or a 2,5-difluorobenzoyl group was used for protection of each of the two model glycopeptides the extent of beta-elimination decreased from 80% to 10% and from 50% to 0%, respectively, as compared to when using the ordinary benzoyl group. Fluorobenzoyl groups thus combine the advantages of the benzoyl group in formation of glycosidic bonds (i.e., high stereoselectivity and low levels of ortho ester formation) with the ease of removal characteristic of the acetyl group. 相似文献
We set up a structural model to study credit risk for a portfolio containing several or many credit contracts. The model is based on a jump-diffusion process for the risk factors, i.e. for the company assets. We also include correlations between the companies. We discuss that models of this type have much in common with other problems in statistical physics and in the theory of complex systems. We study a simplified version of our model analytically. Furthermore, we perform extensive numerical simulations for the full model. The observables are the loss distribution of the credit portfolio, its moments and other quantities derived thereof. We compile detailed information about the parameter dependence of these observables. In the course of setting up and analyzing our model, we also give a review of credit risk modeling for a physics audience. 相似文献
The influence of substrate roughness on the wetting scenario of adsorbed van der Waals films is investigated by theory and experiment. Calculating the bending free energy penalty of a solid sheet picking up the substrate roughness, we show that a finite roughness always leads to triple-point wetting reducing the widths of the adsorbed solid films considerably as compared to that of smooth substrates. Testing the theory against our experimental data for molecular hydrogen adsorbed on gold, we find quantitative agreement. 相似文献
Early in 1988 dryout of fuel rods occurred in the Oskarshamn 2 boiling water reactor. During refuelling it was observed that one corner rod was damaged in each of four fuel assemblies. These were of the SVEA design, SVEA being the trade name of the ABB Atom water cross fuel. The damaged zone covered about 180° of the rod periphery facing the corner sub-channel, over a stretch of about 30 cm with the upper end just below the last downstream spacer.
The dominating cause of the dryout was re-use of fuel channels for ordinary 64-rod fuel, which were located in neighbouring positions to the SVEA fuel. The re-used channels showed excessive bowing because of irradiation. This bow increased the water gap between the fuel assemblies, thus increasing the neutron moderation and the local power around one corner of the SVEA fuel. This and some other factors caused the local peaking factor for the corner rod to increase from 1.04 to 1.38.
The flow and power conditions in the damaged fuel assemblies were calculated by means of the POLCA, PHOENIX, CASMO and CONDOR computer programs. The results of these calculations were used as a base for dryout predictions, which were carried out employing eight correlations, which are available in the open literature. The Barnett, the Becker and the Bezrukow correlations predicted the dryout power within 1%. Also the Condie & Bengston, the EPRI and the XN-1 correlations yielded very good results with accuracies of, respectively, −5.1, −2.3 and 7.3%. The Becker, the XN-1, the Bezrukow and the Condie & Bengston correlations predicted dryout to occur inside of the observed dryout zone of 30 cm length.
It is concluded that the dryout in the Oskarshamn 2 nuclear power plant was not caused by any faults in the design or manufacture of the SVEA fuel, and that the re-use of fuel channels should not be permitted. 相似文献