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121.
This work describes a structure and kinetic stability study of some complexes with the general formula MN, where M are the alkaline earth metal atoms, Be, Mg, Ca, Sr, and Ba. A complex (A) with two points of attachment to the N5 ring is the most energetically favored for all metals considered here. Except for Be, structure (B) containing a mono‐coordinated metal atom is a transition state corresponding to the metal atom transfer around the N5 ring. Pyramidal structure (C) is kinetically unstable with the low isomerization barrier height, ranging from 0.9 to 6.7 kcal/mol. The dissociation barrier heights for the lowest energy isomers (A) are predicted to be 1.2–18.7 kcal/mol (Be to Ba), indicating that kinetic stability increases from lighter to heavier metal atoms. © 2004 Wiley Periodicals, Inc. Int J Quantum Chem, 2004 相似文献
122.
痕量Au Bi和Cd的萃取浮选及原子吸收光谱法测定 总被引:1,自引:0,他引:1
浮选法分离痕量金属离子,由于灵敏度高、选择性强已得到广泛应用。本文利用浮选法使Au~(3 )、Bi~(3 )和Cd~(2 )同KBr反应生成的络合阴离子与碱性染料罗丹明B(RB)生成既疏水又疏有机溶剂的三元离子缔合物,后者经甲苯浮选分出,用二甲基甲酰胺(DMF)溶解后,可用原子吸收法测定Au、Bi和Cd的含量。本方法用于海水,锌片和矿样中上述三种元素的微量测定,可提高检测灵敏度,而且K、Na、Ca、Mg等共存离子不生干扰。具体实验方法如下: 相似文献
123.
124.
The UV photodissociation (<5 eV) of diiodomethane (CH(2)I(2)) is investigated by spin-orbit ab initio calculations. The experimentally observed photodissociation channels in the gas and condensed phases are clearly assigned by multi-state second-order multiconfigurational perturbation theory in conjunction with spin-orbit interaction through complete active space-state interaction potential energy curves. The calculated results indicate that the fast dissociations of the first two singlet states of CH(2)I(2) and CH(2)I--I lead to geminate-radical products, CH(2)I (.)+I((2)P(3/2)) or CH(2)I (.)+ I*((2)P(1/2)). The recombination process from CH(2)I--I to CH(2)I(2) is explained by an isomerization process and a secondary photodissociation reaction of CH(2)I--I. Finally, the study reveals that spin-orbits effects are significant in the quantitative analysis of the electronic spectrum of the CH(2)I--I species. 相似文献
125.
126.
Yong-Sam Chung Sun-Ha Kim Moon Jong-Hwa Young-Jin Kim Jong-Myoung Lim Jin-Hong Lee 《Journal of Radioanalytical and Nuclear Chemistry》2005,267(1):95-107
Summary As part of an air pollution monitoring study, airborne particulate matter (PM2/PM10-2) samples were collected from 2000 to 2003 at two sampling sites in an urban region, Daejeon, the middle of Korea. Mass concentrations
of both fine and coarse fractions and that of the black carbon in the fine particles were measured using the Gent stacked
filter unit sampler and the smoke stain reflectometer, respectively. In the collected samples the concentrations of 24 elements
were analyzed using instrumental neutron activation analysis. Monitored data were investigated for their temporal trends under
different environmental conditions and their seasonal correlation patterns. Crustal enrichment factors were also estimated
to establish the contribution between anthropogenic and crustal origin. Patterns for airborne particle matter (APM) and elemental
concentrations, seasonal variation of some marker elements were investigated. The results can be applied for the investigation
of further air pollution sources and for the evaluation of air quality. 相似文献
127.
Yong-Sam Chung Jong-Hwa Moon Kwang-Won Park Sun-Ha Kim Jin-Hong Lee Kil-Yong Lee 《Journal of Radioanalytical and Nuclear Chemistry》2002,254(1):117-128
Instrumental neutron activation analysis was used for the analysis of 25 trace elements in airborne particulate matter (PM) for air pollution monitoring. For the collection of air samples, the Gent stacked filter unit low volume sampler and two types of Nuclepore polycarbonate filters were employed. Samples were collected at selected sampling dates in suburban and industrial regions of Daejon city in the Republic of Korea. Mass concentrations and black carbon of PM were measured, and enrichment factors were calculated. The results were used to describe the emission sources and their correlation patterns. 相似文献
128.
In order to enhance the
electrogenerative leaching rate of sphalerite reasonably, the basic principle
of generative process was applied to the simultaneous leaching of sphalerite
in the presence of MnO2. It was confirmed by experimental
results that both mental ions and electric energy could be obtained in the
simultaneous electrogenerative leaching process. The leaching cell had the
open circuit potential about 1.0 V, about 2000 C of electric quantity was
obtained, the optimal leaching ratio of Zn2+ and
Mn2+ was 48.5, 39.6% respectively, after electrogenerative
leaching for 11 h. 相似文献
129.
Zhuxing Tang Yun Zhou Yikun Zeng Shuliang Zang Pingang He Yuzhi Fang 《Chromatographia》2006,63(11-12):617-622
A method based on capillary electrophoresis with electrochemical detection has been developed for the separation and determination of epicatechin, isovanillic acid, vanillic acid and myricetin in Dioscorea bulbifera L. and its medicinal preparations. The effects of working electrode potential, pH and concentration of running buffer, separation voltage and injection time were investigated. Under optimum conditions, the analytes could be separated in a 40 mmol L?1 borate buffer (pH 8.7) within 15 min. A 300 μm diameter carbon disk electrode has a good response at + 0.95 V (vs. SCE) for all analytes. The response was linear over three orders of magnitude with detection limits (S/N = 3) ranging from 3.0 × 10?8 g mL?1 to 1.0 × 10?7 g mL?1. The method has been successfully applied to the analysis of real samples. 相似文献
130.
Simultaneous measurement of glucose and glutamine in aqueous solutions by near infrared spectroscopy 总被引:1,自引:0,他引:1
Hoeil Chung Mark A. Arnold Martin Rhiel David W. Murhammer 《Applied biochemistry and biotechnology》1995,50(2):109-125
A method is described for measuring the concentrations of both glucose and glutamine in binary mixtures from near infrared
(NIR) absorption spectra. Spectra are collected over the range from 5000–4000/cm (2.0–2.5μm) with a 1-mm optical path length.
Glucose absorbance features at 4710, 4400, and 4300/cm and glutamine features at 4700, 4580, and 4390/cm provide the analytical
information required for the measurement. Multivariate calibration models are generated by using partial least squares (PLS)
regression alone and PLS regression combined with a preprocessing digital Fourier filtering step. The ideal number of PLS
factors and spectral range are identified separately for each analyte. In addition, the optimum Fourier filter parameters
are established for both compounds. The best overall analytical performance is obtained by combining Fourier filtering and
PLS regression. Glucose measurements are established over the concentration range from 1.66–59.91 mM, with a standard error of prediction (SEP) of 0.32 mM and a mean percent error of 1.84%. Glutamine can be measured over the
concentration range from 1.10–30.65 mM with a SEP of 0.75 mM and a mean percent error of 6.67%. These results demonstrate
the analytical utility of NIR spectroscopy for monitoring glucose and glutamine levels in mammalian and insect cell cultures. 相似文献