紫外光谱结合正交试验设计同时测定水中苯系物

利用正交试验设计,以光谱预处理、特征筛选及多元校正方法为考察因素,每个因素的4种不同方法为水平,确定了水中3种苯系物（苯酚、苯胺及苯甲酸）紫外光谱数据的最佳分析方法,从而建立了其定量校正模型。对于苯酚、苯胺及苯甲酸,其光谱预处理、特征筛选及多元校正分别采用一阶导数+无信息变量消除法（UVE）+偏最小二乘回归（PLSR）,Savitzky-Golay平滑+变量结合种群分析法（VCPA）+PLSR,Savitzky-Golay平滑+移动窗口偏最小二乘法（MWPLS）+PLSR。在独立测试集上3组分的预测误差均方根（RMSEP）分别为0.809 4、0.796 3和0.945 4。水样加标回收实验的回收率为97.79%~103.84%,相对标准偏差（RSD）小于3%。该方法可作为一种同时测定水中苯系物的简便有效方法。     

基于正交模拟试验的矿用空气幕结构优化

为了降低空气幕的能耗,依据空气动力学理论,建立了以双三次方曲线为整流器外轮廓线的矿用空气幕模型,采用正交模拟试验方法,以出风口速度分布均匀性及阻力损失为评价指标,研究了不同结构参数下矿用空气幕内流场分布规律,计算出矿用空气幕出风口断面的速度分布均匀性参数及压力损失,得到了最优的矿用空气幕结构模型,该模型风流速度均匀性参数为0.038 5,压力损失为98.3Pa.结果表明,压力漩涡的大小及流速滞留区的范围与整流器密切相关.对矿用空气幕出风口速度分布均匀性影响最大的是供风器出风口宽度,其次为导流体中截面半径;对矿用空气幕压力损失影响最大的是供风器出风口宽度,其次为整流器及供风器长度.当导流体为圆锥体时,矿用空气幕的性能最优.     

Deflagration to detonation transition in a vapour cloud explosion in open but congested space: Large scale test

The paper reviews large scale experiments with various fuels in air where successful deflagration to detonation transition (DDT) took place. This includes a recent experiment disclosed in the Buncefield R&D program, where DDT developed in the propane/air mixture. The DDT occurred in branches of deciduous trees in a premixed stagnant mixture. An internal R&D investigation programme was initiated to better understand the phenomena. A large scale experiment in an open space with ethane air mixture is presented in the paper. The premixed mixture was ignited at the edge of the congested three-dimensional rigs which consisted of vertical and horizontal pipes. After ignition, the flame accelerated in the congestion and transitioned to detonation at the end of congestion. Stable detonation propagated through the remaining open and uncongested space.The flame acceleration process leading to DDT is scale dependent. It also depends on many parameters leading to a large investigation array and, significant cost. However, such R&D efforts aimed toward a safer plant design, i.e. the prevention of occurrence of a major accident, are a small fraction of a real accident cost.     

基于BP神经网络优化制备Cu-Ce/TiO_2及其光催化活性研究

采用Cu和Ce对TiO2进行改性,基于正交实验设计和BP神经网络研究了Cu-Ce/TiO2中Cu-Ce对TiO2的摩尔百分数、Cu-Ce/TiO2中CuCe摩尔比及Cu-Ce/TiO2烧结温度对Cu-Ce/TiO2光催化降解甲醛溶液性能的影响.同时,对Cu-Ce/TiO2制备方案进行了优化,并运用X射线衍射仪、扫描电子显微镜和紫外-可见分光光度计对最佳条件下制备的Cu-Ce/TiO2进行表征.结果表明,优化的制备条件为Cu-Ce/TiO2中Cu-Ce对TiO2的摩尔百分数为2.88%,Cu-Ce/TiO2中Cu-Ce的摩尔比为1∶1,Cu-Ce/TiO2的烧结温度为570℃.共掺杂Cu离子和Ce离子能有效避免掺杂TiO2晶格内部表层和近表层产生较多的位错,从而抑制晶格畸变增大;诱导TiO2中锐钛矿型晶体向金红石型晶体转变的能力增强,有效抑制电子-空穴对的复合,产生介电局域效应.     

基于SPEI的云南中部区域干旱时空变化特征分析

利用云南中部地区1961~2010年逐月降水和气温资料,采用降水距平百分率和历史旱情资料验证了标准化降水蒸散指数(Standardized Precipitation Evapotranspiration Index,SPEI)在该地区的适用性,并采用Mann-kendall突变检验、Morlet小波和经验正交函数(Empirical Orthogonal Function,EOF)等方法,分析了该地区干旱的时空演变特征,结果表明:(1)SPEI与降水距平百分率在时空上具有很好的相关性,验证了SPEI对降水变化的敏感性;(2)SPEI指数与历史旱情资料比较吻合,能够有效地反映云南中部区域的干旱特征;(3)年均SPEI呈波动下降趋势,干季SPEI降低趋势明显。年均SPEI存在着24a的主周期和9a的次周期,并于1977年发生了突变,此后开始降低,在整体上呈现出干旱化的趋势;(4)从SPEI的空间分布特征来看,其在整体上受大尺度气候系统的影响表现出一致的下降趋势,而在区域内部则表现出东南-西北(干热河谷)的反向结构差异。     

Impact of leakage location and downwind storage tank on the gas dispersion in a typical chemical tank storage area

Toxic gas leakage in a tank area can have catastrophic consequences. Storage tank leakage location (particularly for high leakage) and downwind storage tanks potentially influence gas diffusion in tank areas. In this study, we developed a numerical and experimental method to investigate the impact of a high leakage location and downwind storage tank on gas diffusion based on three (1.05H, 0.90H, and 0.77H, H was the tank height, 22m) leakage field experiments on the leeward side of storage tank, which have been not conducted before. The experiments revealed an unexpected phenomenon: the maximum ground concentration first decreased and then increased with increasing leakage height. The simulations illustrated that the differences in micrometeorological conditions caused the maximum ground concentration of gas emitted from the roof to be higher than that emitted from the tank wall near the storage tank height. The downwind storage tank 1) had little influence on the entire diffusion direction but altered the local diffusion pattern; 2) reduced the maximum ground concentration (∼18.7%) and the distance from the emission source (approximately a storage tank diameter); and 3) had strong influences on the concentration, velocity, turbulence, and pressure on the leeward side. The concentration negatively correlated with the velocity, pressure, and turbulence in the middle of the two storage tanks on wind centerline. Our results can improve understanding of gas dispersion in tank areas and provide references for mitigating loss and protecting lives during emergency response processes.     

重金属铜在砂质壤土土柱中运移的数值模拟

通过室内土柱出流实验,分析了重金属离子铜在饱和砂质壤土中的运移行为,发现高浓度的入流液有利于铜离子的运移。同时借助于软件包CXTFIT,用确定性平衡模型和非平衡两区模型对铜离子的出流动态进行了拟合,并预测了土柱不同深度处铜离子浓度随时间的变化过程。结果表明,室内饱和均质条件下,应用确定性平衡模型拟合参数模拟精度要高于非平衡两区模型,可以不用考虑不动水体对铜离子运移的影响。     

SPME-G C法测试TCE、PCE条件的正交优化试验研究

运用正交设计方法对SPME-GC法测试三氯乙烯、四氯乙烯的固相微萃取条件进行优化。首先选择样品量、NaCl用量、萃取温度、萃取时间、解析温度等因素,设计5因素3水平正交试验方案。分析数据得到优化条件为NaCl用量30 g/L,萃取温度25℃,解析温度210℃,同时得出样品量与萃取时间是对试验结果具有显著意义的影响因素,采用二次回归正交组合设计试验对其进一步优化,并对结果进行回归分析,得到最优条件为样品量为5.5 mL,萃取时间为20.13 min。     

银、钕掺杂TiO_2催化光解甲基橙的实验研究

实验用水热合成法制备出银、钕掺杂TiO2催化剂粉体,然后以高压汞灯为光源,掺杂TiO2催化剂粉体为光化降解催化剂,探究对甲基橙模拟印染废水光催化分解的效果。光解实验研究采用正交设计法,以模拟废水浓度、催化剂用量、光照时间以及pH为因素,各因素选取4个水平,对催化光解甲基橙染料的降解率进行评价。分析结果表明:银、钕掺杂TiO2催化剂对甲基橙光化降解有良好的效果,最佳实验条件为:溶液pH为5,甲基橙的初始质量浓度为2 mg/L,催化剂投加量60 mg/L和光照时间80 min。在最佳条件下,连续光照8 h后甲基橙的降解率达到92%以上。