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1.
1,3-Diarylpropynones were cleanly converted to the corresponding 3-arylindenones in various superacidic media. This new, simple, one-pot reaction proved to be efficient (yields up to 95%) and very fast (reaction time less than 30 min). 相似文献
2.
The basic theory of symplectic algorithm was introduced. A comparison between Runge-Kutta method and symplectic integration method was preformed in the simulation of the long time behavior of H + H2 system on BKMP potential energy surface. Our results reveal a dis-sipative behavior in the integral of ordinary differential equation by the fourth order Runge-Kutta method, which causes incorrect simulation results in QCT calculations. However, when the symplectic integration method is applied, the dissipative behavior is not found in the same system. When the initial state is the same, the energy deviation of fourth order symplectic integral method is almost one percent of that of fourth order Runge-Kutta method in a 60000-step simulation, and that of sixth order symplectic integral method is much less. These results show that the symplectic integral methods are always the better choice in the integral calculation of the long time behavior in maintaining energy conservation. 相似文献
3.
本文用变分过渡态理论,首次对无鞍点的释能反应O+CS→CO+S、O+CO→CO+O和S+CS→CS+S进行了动力学研究,考察了反应动力学瓶颈区性质,计算了反应的速度常数,并将O+CS反应的速度常数值与实验值及经典轨迹计算结果进行了比较,三者基本相符. 相似文献
4.
Klaus Sommer 《无机化学与普通化学杂志》1971,383(2):136-143
Hydrolysis of 1-chloro-arsolane, C4H8AsCl, and 1-chloro-arsenane, C5H10AsCl, leads to oxides C8H10As2O and C10H20As2O, respectively. On direct alkylation of arsenic trioxide with 1.4-butane- and 1.5-pentane-bis-magnesium bromide these oxides are formed only in trifling amounts. Better results are gained by alkylation of N,N-dimethylaminodichloroarsane into amino-arsolane and amino-arsenane, which are also transformed into these oxides by hydrolysis. By hydrolysis of 1.4-dichloro-diarsenane only a small amount of 1.4-epoxo-arsenane is formed, whereas mainly a dimer of this oxide results. Solvolysis of 2.6-dichloro-diarsa-[3.3.0]-bicyclooctane with water, hydrogen sulphide or methylamine leads to 7-oxa-, 7-thia- and 7-methylaza-2.5-diarsa-noradamantane, respectively. 相似文献
5.
在室温下,于pH 2.5的Britton-Robinson缓冲溶液中及非离子表面活性剂OP存在下,牛血清白蛋白(BSA)与偶氮胂-DBS的复合物的最大吸收在514 nm波长处,但显色复合物与试剂空白吸光度之差在370 nm处最大,选择在370 nm处测定,反应迅速完成。非离子表面活性剂OP可提高反应灵敏度及复合物稳定性。乙醇可提高体系灵敏度。BSA的质量范围在0~60.0 mg.L-1范围内符合比耳定律,方法表观摩尔吸光率3ε70 nm=8.58×105L.mol-1.cm-1。方法用于测定血清样品中蛋白质的总量,5次测定值的RSD为0.60%,回收率为98.0%。 相似文献
6.
The elemental quantification in plasma-based SNMS is hampered by the matrix dependence of the detection efficiencies. The signals of elements of unknown compounds can only be converted to concentrations with mean detection factors resulting in concentrations with an uncertainty mainly given by the matrix effect. This situation can be considerably improved by energy measurements of the sputtered particles. The energy distribution (ED) can be used in two ways. First, the exact knowledge of the ED to each detected element allows an element specific integration of the directly sputtered atoms eliminating thermal species from resputtered wall deposition. For a set of copper compounds the spread of the Cu detection factors could be reduced from ± 63% for the conventional measurement to ± 35% using energy resolved data. Second, the shape of the ED of postionised atoms differs considerably from all interfering species, such as clusters as well as twice charged atoms which could superimpose on the atomic signals. A quantitative shape analysis of the measured ED was developed to correct for these interfering species. Examples are given for both superpositions with cluster intensities and interferences with twice charged intensities. To reduce the additional time necessary to obtain the ED, the number of energy resolved data points was reduced in steps down to 3 points only which still reduced a superposition error to half of the value without ED based correction. 相似文献
7.
H. D. Sommer und F. Umland 《Fresenius' Journal of Analytical Chemistry》1977,285(5):359-361
Zusammenfassung Alizarin S und seine 11-Metallchelate lassen sich an der Quecksilbertropfelektrode reduzieren. Aus der Beeinflussung der diffusionskontrollierten und der Adsorptionsstufe durch die Chelatbildung lassen sich Aussagen über die Konstitution und Ladung der adsorbierten Chelate machen: Beryllium wird in peri-, Aluminium und Gallium werden in ortho-Stellung des Alizarinmoleküls gebunden. Die 11-Chelate des Be und Al sind ungeladen. Das Ga-Chelat ist negativ geladen und enthält offensichtlich zusätzliche anionische Liganden.Wir danken der Deutschen Forschungsgemeinschaft, Bonn-Bad Godesberg, dem Minister für Wissenschaft und Forschung des Landes Nordrhein-Westfalen, Landesamt für Forschung, sowie dem Verband der Chemischen Industrie, Fonds der Chemie, für Sachbeihilfen. 相似文献
8.
9.
L. Sommer 《Fresenius' Journal of Analytical Chemistry》1962,186(2):320
Ohne Zusammenfassung 相似文献
10.
D. Grunenberg D. Sommer K. H. Koch 《Fresenius' Journal of Analytical Chemistry》1995,353(5-8):514-520
For the analysis of surfaces with poor conductivity the use of the direct current sputter process, usual in SNMS, produces unreproducible depth profiles with often widened transition widths. An efficient method for eliminating static charging in the case of non-coducting samples is the use of a high-frequency discharge. By comparison of the direct current mode with high frequency mode it is shown, that the use of SNMS with HF sputtering is the universal analysis method for most matrices, technical surfaces as well as oxidic materials. For non-conducting or poorly conducting samples, however, matrix-adjusted factors are to be used. 相似文献