混合物质谱的简单分类算法

有毒化合物质谱分类是以光谱数据的数值特性为基础的。这此数据的计算机分类提供了各种参数,用以确定属于有毒化合物中某一类的对应化合物。质谱数据的简单分类算法常被用于自相关变换质谱的主分量建模。主分量的有效值为相互确认为确定。对环境空气中１１９种被监测的有毒化合物,有色谱－质谱联用的试验和校正数据所得到的４类预报正确率为７６．５％。     

汽车零部件金属卤素灯阳光模拟试验与户外自然曝晒的相关性研究

目的 探究汽车零部件金属卤素灯阳光模拟加速试验与户外自然曝晒的关系。方法 使用3种典型高分子透明材料分别进行阳光模拟加速试验、AIMBOX/Arizona户外曝晒和Florida户外曝晒,基于试验后样品的黄变值,比较阳光模拟试验与户外曝晒的相关性,并对阳光模拟试验与户外曝晒的加速性进行探讨。结果 阳光模拟（IP/DP箱）加速试验与AIM BOX/Arizona户外曝晒高度相关,综合加速倍率约是AIM BOX/Arizona户外曝晒的3倍。阳光模拟（IP/DP箱外）加速试验与Florida户外曝晒高度相关,综合加速倍率是Florida户外曝晒的7倍。结论 基于3种典型材料研究可知,汽车零部件阳光模拟加速试验与典型户外自然曝晒具有一定相关性。     

基于《电力设施抗震设计规范》的地震动随机模型参数研究

依据《电力设施抗震设计规范》(GB50260-96)中的设计反应谱,对随机地震动功率谱参数的取值进行了具体研究。首先,采用时间包络函数考虑地震的非平稳特性,给出了地震动持时的取值;然后,根据加速度峰值等效原则,迭代计算得到地面的加速度功率谱密度曲线;最后,选定Clough-Penzien修正过滤白噪声模型作为拟合函数,通过非线性拟合技术拟合了与《规范》中的地震烈度、场地类别相对应的谱参数。研究结果表明,Clough-Penzien修正过滤白噪声模型能较好地拟合其曲线形状。本文给出了相对于规范中的地面加速度功率谱参数值,可供这种模型作为地震地面运动输入时选用。     

苯醌类与苯醌亚胺类在日光/Fenton体系中的光敏性

基于苯酚降解中间产物（苯醌）、酸性甲基橙的目标化合物,研究了苯醌类与苯醌亚胺类在光/Fenton体系中的降解特性,分析了苯醌及酸性甲基橙的光敏特性,测定了光敏剂存在的情况下日光/Fenton和UV/Fenton体系中·OH的产量.结果表明,苯醌类光解,由于其光敏性好,能促进日光体系产生更多的·OH,日光/Fenton法好于UV/Fenton法.苯醌亚胺类降解,浓度较低时,UV/Fenton法好,浓度较高时,日光/Fenton法好,造成这种现象的主要原因是苯醌亚胺类光敏性一般,浓度低时日光体系中·OH的产量少于紫外体系,但苯醌亚胺类降解过程中有苯醌类生成,苯醌类的光敏性比苯醌亚胺类好,苯醌亚胺类浓度越高,其降解产物中苯醌类越多,进而导致日光体系中¹O₂、O₂^-·和·OH的产量多于紫外体系.     

氯化对二级处理出水中溶解性有机物结构的影响

以哈尔滨市W污水处理厂污水为研究对象,利用XAD树脂对二级处理出水中的溶解性有机物(DOM)进行分级分离.按照DOM在不同树脂上的吸附特性将其分为5个部分:疏水性有机酸(HPO-A)、疏水性中性有机物(HPO-N)、过渡亲水性有机酸(TPI-A)、过渡亲水性中性有机物(TPI-N)和亲水性有机物(HPI).考察了二级处理出水中有机组分的组成分布、三卤甲烷生成势、紫外光谱和红外光谱.结果表明,二级处理出水中的主要成分是HPO-A和HPI,两者含量之和达70.8%.HPO-A是加氯消毒时产生三卤甲烷的主要有机组分,其三卤甲烷生成活性(STHMFP)为232.9μg/mg.而HPO-N、TPI-A、TPI-N和HPI的STHMFP介于100～125μg/mg之间.氯化反应后,HPO-A、HPO-N、TPI-A和HPI的紫外-可见吸光度均降低,而TPI-N则相反.并且HPO-A、HPO-N、TPI-A和TPI-N中的O-H、C=C和苯环的含量降低,而C-O的含量升高,还生成了C=O和C-Cl.     

川西高原河流水体CDOM的光化学降解特性

川西高原部分河流溶解性有机碳(DOC)含量极高,因有色溶解性有机质(CDOM)具有独特的光学特性,其光降解特征与规律对于分析高寒区天然水体DOC动态及区域水-陆碳循环具有重要的环境意义.本文选取川西高原两种主要地貌类型的河流共5条,即高山峡谷区河流杂谷脑河、抚边河及岷江,丘状高原区河流白河、黑河,对河流水体CDOM三维荧光光谱(EEMs)与紫外-可见光吸收光谱(UV-Vis)采用平行因子分析(PARAFAC)与二维相关光谱(2D-COS)进行分析.结果表明:①白河和黑河CDOM的5 d降解率分别为64. 85%和63. 43%,光降解速率常数分别为0. 167 d-1和0. 173 d-1;抚边河CDOM浓度低(0. 71 m-1)光降解现象不明显,杂谷脑河和岷江CDOM光降解行为较为复杂;②在光降解过程中,除岷江外其余4条河流荧光溶解性有机质(FDOM)内源特征(FI)逐渐减弱,黑河和白河CDOM芳香性、疏水性特征(SUVA254和SUVA260)及腐殖化程度(HIXa)逐渐降低;③川西高原5条河流中FDOM组分均呈2类4个组分,即C1(275/310 nm,类酪氨酸)、C2 [280(250)/400 nm,UVA类腐殖质]和C3(255/440 nm,UVA类腐殖质)、C4[270(360)/492 nm,UVA类腐殖质],类腐殖质FDOM较易光降解;④5条河流中UVA类腐殖质FDOM(尤其是500 nm发射波段)光降解反应先于类酪氨酸物质;丘状高原河流中UVA类腐殖质FDOM对于光照的敏感度大于高山峡谷区河流;⑤白河的主成分分析中识别出了2个因子,解释了这些参数变化的87. 28%,反映了光降解过程对于CDOM特征、荧光组分等方面的影响.     

日光/H2O2/草酸铁络合物光解水溶液中的直接耐酸大红

以H2O2/草酸铁络合物作光氧化剂,利用太阳光对水溶液中的直接耐酸大红进行了光氧化降解试验研究。结果表明,在日光照射下,H2O2/草酸铁络合物能使溶液中直接耐酸大红迅速光解,晴天光照15min或阴天光照30-40min,溶液（直接耐酸大红的质量浓度为50mg/L）可褪至无色;溶液的初始pH对染料光解有显著影响;pH为2-4时光解效果最佳;提高H2O2浓度可以提高光解速率,但H2O2的利用率会降低。     

Chemical and spectroscopic characterization of organic matter during the anaerobic digestion and successive composting of pig slurry

In this work, anaerobic digestion of pig slurry and successive composting of the digestate after centrifugation were studied by means of chemical analysis, FTIR and fluorescence spectroscopy as excitation–emission matrix (EEM). Chemical analysis highlighted the organic matter transformation occurring during the processes. A decrease of volatile solids and total organic carbon were observed in the digestate with respect to the fresh pig slurry as a consequence of the consumption of sugars, proteins, amino acids and fatty acids used by microorganisms as a C source. Water Extractable Organic Matter (WEOM) was obtained for all samples and fractionated into a hydrophilic and a hydrophobic fraction. The highest WEOM value was found in the pig slurry indicating a high content of labile organic C. The digestate centrifuged and the digestate composted showed lower hydrophilic and higher hydrophobic contents because of the decrease of labile C. Total phenolic content was lower in the digestate with respect to fresh pig slurry sample (36.7%) as a consequence of phenolic compounds degradation. The strong decrease of total reducing sugars in the digestate (76.6%) as compared to pig slurry confirmed that anaerobic process proceed mainly through consumption of sugars which represent a readily available energy source for microbial activity. FTIR spectra of pig slurry showed bands indicative of proteins and carbohydrates. A drop of aliphatic structures and a decrease of polysaccharides was observed after the anaerobic process along with the increase of the peak in the aromatic region. The composted substrate showed an increase of aromatic and a relative decrease of polysaccharides. EEM spectra provided tryptophan:fulvic-like fluorescence ratios which increased from fresh substrate to digestate because of the OM decompostion. Composted substrate presented the lowest ratio due to the humification process.     

Changes in the structure of a <Emphasis Type="Italic">Dactylorhiza incarnata</Emphasis> (L.) Soó population during the overgrowing of a meadow-bog community complex in the Moscow region

The overgrowing of meadow-bog communities by shrubs and trees (age 5–40 years, crown closure 0.4–0.9) leads to a decrease in incident illumination. As a consequence, juvenile and generative plants disappear from D. incarnata population loci, their average ecological density decreases, and the loci enter the state of regression. The digging activity of wild boars disrupts phytocenotically closed groups of longirhizomatous herbs, thereby creating favorable conditions for seed reproduction of D. incarnata. The species begins to form population loci with a complete ontogenetic spectrum and high ecological density, eventually restoring the normal (definitive) population structure.     

Screening Capsicum Accessions for Capsaicinoids Content

Ninety Capsicum accessions selected from the USDA Capsicum germplasm collection were screened for their capsaicinoids content using gas hromatography with nitrogen phosphorus detection (GC/NPD). Fresh fruits of Capsicum chinense, C. frutescens, C. baccatum, C. annuum, and C. pubescens were extracted with methanol and analyzed for capsaicin, dihydrocapsaicin, and nordihydrocapsaicin. Mass spectrometry of the fruit crude extracts indicated that the molecular ions at m/z 305, 307, and 293, which correspond to capsaicin, dihydrocapsaicin, and nordihydrocapsaicin, respectively, have a common benzyl cation fragment at m/z 137 that can be used for monitoring capsaicinoids in pepper fruit extracts. Capsaicin and dihydrocapsaicin were the dominant capsaicinoids detected. Capsaicin concentrations were typically greater than dihydrocapsaicin. Concentrations of total capsaicinoids varied from not detectable to 11.2 mg fruit^?1. Statistical analysis revealed that accession PI-441624 (C. chinense) had the highest capsaicin content (2.9 mg g^?1 fresh fruit) and accession PI-497984 (C. frutescens) had the highest dihydrocapsaicin content (2.3 mg g^?1 fresh fruit). Genebank accessions PI-439522 (C. frutescens) and PI-497984 contained the highest concentrations of total capsaicinoids.