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31.
Mei‐Jiau Huang 《国际流体数值方法杂志》2005,48(5):521-539
The technique of splitting a fat vortex element (with a core width larger than some threshold) into some thin ones in order to fix the convergence problem of the core‐spreading vortex methods is convenient and efficient. In particular, it keeps the method purely Lagrangian. In the present investigation, the splitting process is further viewed as part of the physical diffusion process. A new splitting method in which several weaker child vortices surround a thinned but still strong parent vortex is proposed. It is found that because of the survival of the parent vortex, the error arising from the splitting events can be largely reduced. The computational amount on the other hand is kept reasonably large by merging similar and close‐by vortices. The merging scheme designed herein not only involves fewer restrictions but also allows merging vortices of opposite rotations through the viewpoint of remeshing. The validity and accuracy of these techniques, proposed particularly for simulations undergoing lots of splitting and merging events, are verified by successfully simulating the interactions between two Burgers vortices under an external straining field. Copyright © 2005 John Wiley & Sons, Ltd. 相似文献
32.
本文综述了半导体氧化物光催化裂解水制氢的反应机理,以及近年来半导体光催化裂解水制氢的研究进展。讨论了各种因素对材料光催化性能的影响以及改性方法,并对今后的研究方向提出了一些建议。 相似文献
33.
H. Wätzig 《Chromatographia》1992,33(5-6):218-224
Summary It is still difficult to determine peaks and peak boundaries properly, though peak recognition is very important for the precision of quantitative data. A new computer program overcomes these problems using a method which is adapted from human judgements. The algorithm was developed for HPLC but can also be used in other fields of analytical chemistry. 相似文献
34.
Òscar Rubio-Pons Boris Minaev Oleksandr Loboda Hans Ågren 《Theoretical chemistry accounts》2005,113(1):15-27
The phosphorescence spectrum of p-dichlorobenzene has been calculated using multiconfiguration self-consistent-field wave functions and the quadratic response technique. Attention has been paid to the intensity distribution of the singlet–triplet (3B1u1Ag) transition through a number of vibronic subbands. The second order spin–orbit coupling (SOC) contribution to the spin splitting of the 3B1u (3*) state is found to be almost negligible, and the calculations therefore provide a good estimate for the zero-field splitting (ZFS) parameters based only on the electron spin–spin coupling expectation values. Nuclear quadrupole resonance constants for the different Cl isotopes are also calculated to accomplish the ZFS assignment. The electric dipole activity of the spin sublevels in the triplet–singlet transitions to the ground-state vibrational levels is estimated by calculations of derivatives using distorted geometries which are shifted from the equilibrium position along different vibrational modes. A vibrational analysis of the phosphorescence spectrum, based on the SOC-induced mixing of the singlet and triplet states calculated along different vibrational modes, provides reasonable agreement with experimental data.Acknowledgment O. R.-P. would like to thank the European MOLPROP network for support. The authors thank Alexander Baev for fruitful discussions. This work was supported by the Swedish Royal Academy of Science (KVA). 相似文献
35.
Summary A simplex method for determining the constantsS andk
o from the equation lnk’=lnk
o−S ϕ (was developed and applied to the reversed phase separation of high molar mass polystyrenes using gradients of any curvature.
Experimental retention times described using the equation had a standard deviation of 1.1%. The inclusion of a quadratic term
in the equation was found to be unwarranted. BothS and lnk
o varied linearly with ln molar mass. The logarithm of peak width of an eluting polystyrene peak was found to be a linear function
of the mobile phase composition at elution. The slope was equal toS. 相似文献
36.
Photocatalytic oxidation of water is a promising method to realize large-scale H2O2 production without a hazardous and energy-intensive process. In this study, we introduce a Pt/TiO2(anatase) photocatalyst to construct a simple and environmentally friendly system to achieve simultaneous H2 and H2O2 production. Both H2 and H2O2 are high-value chemicals, and their separation is automatic. Even without the assistance of a sacrificial agent, the system can reach an efficiency of 7410 and 5096 μmol g–1 h–1 (first 1 h) for H2 and H2O2, respectively, which is much higher than that of a commercial Pt/TiO2(anatase) system that has a similar morphology. This exceptional activity is attributed to the more favorable two-electron oxidation of water to H2O2, compared with the four-electron oxidation of water to O2. 相似文献
37.
用峰鉴别技术反相高效液相色谱法测定火锅汤料中微量吗啡 总被引:3,自引:0,他引:3
本文报道了以峰鉴别技术为定性依据的测定火锅汤料中微量吗啡的反相高效液相色谱法。本法采用改良的Stas-otto法分离提取复杂样品中的微量吗啡。由于采用峰鉴别技术,增加了定性参数,大大提高了定性方法的准确性。本法简便、快速。最低检出浓度为0.04mg/L。在数十例样品分析中,与其它仪器分析结果比照,非常符合。 相似文献
38.
用二维色谱技术测定聚合反应气体组成 总被引:1,自引:1,他引:1
介绍一种无阀切换的二维气相色谱分析方法。采用两根不同性质的色谱柱并联连接,样品分别经两根色谱柱分离后汇合在一起进入同一检测器。一次进样可同时测定H2、O2、N2及C1~C3的组分。 相似文献
39.
The sequence structures of emulsion-processed SBR and solution-processed (by lithium catalyst) SBR were investigated by ~(13)C-NMR spectroscopy. Seventeen peaks within unsaturated carbon region were recorded under the adopted experimental conditions. Assignments for these peaks were made by empirical-parameter-evaluation method. 相似文献
40.