固相微萃取/GC直接测定废水中的三种氯酚

研究了运用固相微萃取／GC直接测定水中的三种氯酚的方法，得到了分析三种氯酚的SPMF最佳萃取条件。选取聚丙烯酸酯（PA）萃取头，水溶液调pH=2,并用NaCl饱和，室温下在持续磁力搅拌下直接萃取40min，纤维萃取头在260℃脱附5min。所建立的方法适于快速、方便地测定水中三相氯酚，无须浓缩和预处理。     

磁共振方法研究12-钨磷酸水合物中水分子的运动状态

本文使用以Cu(Ⅱ)为顺磁探针的ESR以及宽谱线~1H-NMR等磁共振方法,研究了12-钨磷酸水合物中水分子的运动状态,结果表明水合水的活动性不仅取决于温度,而且还与12-钨磷酸水合物中的含水量有关。     

Temperature Development of Homo- and Hetero-Clustering in Saturated Vapors

Computational findings of temperature increase of clustering degree in saturated vapors are analyzed. A thermodynamic proof is presented and a simple criterion derived. Illustrations are based on saturated steam, magnesium and carbon vapor. The results are applicable to synthesis of fullerenes, metallofullerenes, and heterofullerenes, chemical vapor deposition technique, or atmospheric chemistry.     

高温氧化-化学发光检测法测定水中总氮

采用高温氧化-化学发光检测法（high temperature oxidation ＆ chemiluminescence, HTO-CL）进行水质总氮（TN）的在线测定。总氮浓度（CN）与化学发光的强度（IN）呈良好的线性关系，线性区间为0．05～100mg／L。对真实水样采用本方法进行测定，其结果与国标方法相符，回收率在90％～110％之间。以本方法为工作原理的TN-2000型总氮测定仪可用于地表水质及污水的在线监测。     

The optimal amount of isotopic spike solution for ultratrace analysis by isotope dilution mass spectrometry

 Inductively coupled plasma mass spectrometry (ICP-MS) and high resolution inductively coupled plasma mass spectrometry (HR-ICP-MS) are powerful methods of determining metallic impurities in the low- and sub-ppt level in process media such as ultra-pure water used in semiconductor and wafer manufacturing. By using mass spectrometers for analysis, an isotope dilution analysis (IDMS) is possible. The reproducibility of an IDMS is unmatched. For concentration levels near the instrument detection limit a novel method is reported to find the optimal amount of isotopic spike solution. This optimal value can be derived by the law of propagation of uncertainty combined with the Poisson statistics of the measured number of counts. Generally, an excess of isotopic spike solution should be used to provide results of lowest possible uncertainty. The results are presented in a diagram for easy practical use. Received: 14 October 1997 · Accepted: 13 February 1998     

Summary of ISO/TC 201 standard: XXI. ISO 21270:2004—Surface chemical analysis—X‐ray photoelectron and Auger electron spectrometers—Linearity of intensity scale

This International Standard specifies two methods for determining the maximum count rate for an acceptable limit of divergence from linearity of the intensity scale of Auger and x‐ray photoelectron spectrometers. It also includes methods to correct for intensity non‐linearities so that a higher maximum count rate can be employed for those spectrometers for which the relevant correction equations have been shown to be valid. Copyright © 2004 John Wiley & Sons, Ltd.     

Comparison of the Dynamics of Water Molecules in Crystals of Proton-Ordered Ice IX and Its Proton-Disordered Analog III

A computer simulation of proton-ordered ice IX and its proton-disordered analog III (768 molecules, 90 K) was carried out by the molecular dynamics method using Poltev–Malenkov's potential. For ice IX, the differences in the dynamic characteristics of molecules with O(1) and O(2) are much wider than those in the case of ice III. The libration spectrum of ice IX has a number of distinct acute peaks, and the spectrum of ice III is strongly smoothed. These peculiarities are explained by the proton ordering of ice IX and disordering of ice III. The latter is responsible for the great differences in the short- and especially long-range environment of water molecules in ice crystals and hence for the presence of many molecules with different dynamic characteristics. Thus averaging over a large number of different vibrational spectra of molecules leads to a smoothed total spectrum in the case of the proton-disordered crystal modification of ice.     

Summary of ISO/TC 201 Standard XI. ISO 17974:2002—Surface chemical analysis—High‐resolution Auger electron spectrometers—Calibration of energy scales for elemental and chemical‐state analysis

This International Standard specifies a method for calibrating the kinetic energy scales of Auger electron spectrometers for elemental and chemical‐state analysis at surfaces. It is only applicable to instruments that incorporate an ion gun for sputter cleaning. This International Standard further specifies a method to establish a calibration schedule, to test for the kinetic energy scale linearity at one intermediate energy, to confirm the uncertainty of the scale calibration at one low and one high kinetic energy value, to correct for small drifts of that scale and to define the expanded uncertainty of the calibration of the kinetic energy scale for a confidence level of 95%. This uncertainty includes contributions for behaviours observed in interlaboratory studies but does not cover all of the defects that could occur. This International Standard is not applicable to instruments with kinetic energy scale errors that are significantly non‐linear with energy, to instruments operated at relative resolutions poorer than 0.2% in the constant ΔE/E mode or poorer than 1.5 eV in the constant ΔE mode, to instruments requiring tolerance limits of ±0.05 eV or less or to instruments equipped with an electron gun that cannot be operated in the energy range 5–10 keV. This standard does not provide a full calibration check, which would confirm the energy measured at each addressable point on the energy scale and should be performed according to the manufacturer's recommended procedures. Crown Copyright © 2003. Published by John Wiley & Sons, Ltd.     

Modeling Studies of the Formation and Destruction of NO in Pulsed Barrier Discharges in Nitrogen and Air

This paper presents the results of modeling studies on the formation and destruction of NO in pulsed barrier discharges in nitrogen and air. The goals of this work are to identify the major processes involved in the formation and destruction of NO in air discharges, to distinguish between oxidative and reductive paths for NO destruction, to explore the potential importance of excited state reactions, to evaluate the role of water in such systems, and to identify the final products in the absence of heterogeneous processes. In all cases, the systems were modeled with 100×10^–4% (100 ppm) of added NO, with and without 3% added water. The focus in all of this work is chemistry in the post-pulse regime.     

B108中温变换催化剂宏观动力学的研究

常压下以内循环无梯度反应器研究了B108铁基中温变换催化剂上水煤气变换反应宏观动力学。测定了反应速率,并用马夸特非线性参数估值法获得了幂函数宏观动力学模型r_s=37.67exp(-43982/RT)y_(CO)~(0.7552)y_(H_2O)~(-0.0367)Y_(CO_2)~(-0.4874)y_(H_2)(1-β)根据方差分析和残差分析,证实模型是高度显著的。由实验数据计算出相应反应条件下的效率因子。内扩散对原粒度B108催化剂上的反应具有严重影响。模型用于工业变换炉催化剂的用量核算,模型值与实际值符合良好。