不同量子化学算法在多环芳烃光解行为定量结构-性质关系(QSPR)中的应用

以采用MINDO/3、MNDO和AMI算法计算的17种多环芳烃（PAHs）的前线分子轨道能为分子结构参数,进行了这些PAHs光解速率常数的定量结构－性质相关（QSPR）的研究,并与基于PM3算法得到的QSPR模型进行了比较,研究结果表明,应用PM3算法得到的前线分子轨道能进行这些PAHs光解速率常数QSPR拟合的结果最好,其次是AMI算法,而MINDO/3和MNDO算法得到的结果较差。     

大别山超高压变质杂岩的折返

作为世界上规模最大的一个超高压变质带，大别山超高压变质杂岩是扬子板块 与中朝板块在三叠纪碰撞造山的产物，表现为扬子板块呈北北东向斜向俯冲到中朝板块之下。 超高压变质杂岩的折返机制是个复杂的动力学过程，折返速率也随时间推移而变慢。早期阶段 （三叠纪－早侏罗纪）同碰撞期浮力驱动下高压－超高压变质杂岩在俯冲带内沿道冲－韧性剪 切断裂快速挤侵（ｅｘｔｒｕｓｉｏ）到地壳层位，折返速率高达４ｍｍ／年；中期伴随着巨厚造山带山根的 拆沉，上部发生拉张塌陷，使超高压变质杂岩进一步减压，但折返速率缓慢，～(４０)Ａｒ／~(３９)Ａｒ年代学显 示１１７Ｍａ前它们仍处在地壳的较深部；晚期伴随着晚侏罗－早白垩纪花岗质岩浆的上升侵位， 超高压变质杂岩进一步抬升，同时低角度正断层发育，此阶段的折返机制类似于变质核杂岩模 型。整个折返过程中剥蚀一直在起作用。     

垃圾焚烧烟气中HCl与消石灰的反应机理研究

测试了两种消石灰与垃圾焚烧烟气中HCl的反应率,得出了消石灰的反应率与反应时间的反应曲线,分析了消石灰与HCl的反应机理及影响消石灰最终反应率的因素。试验结果表明,消石灰与HCl反应初期按灰层扩散控制进行,两种消石灰的最终反应率分别为16％和36％。     

矿化垃圾生物覆盖层减少垃圾填埋场CH4、N2O和CO2释放的效应研究

对利用矿化垃圾构建生物覆盖层以削减填埋场温室气体的释放问题进行了深入研究,分析了环境因素对CH4释放的作用,考察了作为生物覆盖层材料的矿化垃圾的厚度变化对CH4氧化的影响.结果表明,温度为5～45℃时,矿化垃圾对CH4的氧化速率平均值分别约为黏性土和砂性土的2.35和4.71倍,CH4氧化速率随温度的升高而增加,并在35℃时达到最大值.当含水率w为16％ ～ 24％时,纯矿化垃圾覆盖层、半矿化垃圾覆盖层和砂性土覆盖层CH4氧化能力均达到最大.砂性土覆盖层和半矿化垃圾覆盖层CH4释放通量平均值分别为纯矿化垃圾覆盖层的329.8倍（P＜0.05）和91.7倍（P＜0.05）,添加矿化垃圾填料会增加覆盖层N2O释放通量,纯矿化垃圾覆盖层N2O（以N计）释放通量平均值分别为半矿化垃圾覆盖层和砂性土覆盖层的2.1倍（P＜0.05）和3.5倍（P＜0.05）.     

菌根真菌侵染对植物生物量累积的影响

为了从生态系统尺度探讨菌根资源与植物生物量累积的关系,调查了鼎湖山不同成熟度的三个森林群落主要优势树种的菌根侵染情况.综合分析各森林群落优势树种的个体数、生物量和菌根侵染率发现：1）菌根侵染率与径向生长速率相关,植物生长迅速的阶段菌根侵染率更高.中径级（胸径15-30 cm）的马尾松（Pinus massoniana）和锥（Castanopsis chinensis）的侵染率比小径级（胸径1-15 cm）个体的侵染率高,而大径级个体（胸径30 cm 以上）的侵染率略低于中径级个体的侵染率.木荷（Schima superba）则表现出侵染率随着胸径增大而增高的趋势.2）树种在群落内的侵染率越高,其对群落生物量的贡献率越大.如马尾松在马尾松林和混交林的侵染率分别为（77.30±18.02）%和（40.50±14.42）%,其对马尾松林群落生物量的贡献率达到87.43%,是对混交林生物量贡献率（17.51%）的5 倍.混交林和阔叶林的共有优势树种锥的侵染率和生物量贡献率也有存在相同规律.3）根系碳储量占群落总碳储量比例较高的群落其优势树种平均侵染率相对较高.马尾松林、混交林和季风常绿阔叶林中,根系碳储量占群落总碳储量的比例分别为55%、54%、42%,群落优势树种平均侵染率分别为（66.73±10.55）%、（46.97±27.28）%、（54.22±25.45）%,马尾松林的根系碳储量和平均侵染率均高于混交林和季风常绿阔叶林.以上结果表明,菌根真菌侵染对于植物个体生长速率以及群落水平的生物量累积具有-定的促进作用.     

钒胁迫对水稻幼苗生理生化和富集特性的影响

水稻（Oryza.sativa L.）是我国最重要的粮食作物之一,水稻产量占粮食总产量的一半以上,一旦水稻受到重金属污染,将会影响水稻植株的正常生长和生理特性。目前关于钒胁迫对水稻植株生理特性指标的影响方面报道较少。通过水培实验,研究了不同钒（V）质量浓度（0、4、8、12、16、20 mg·L-1）对水稻幼苗（Oryza.sativa L）生理生化和富集特性的影响。结果表明：随着V胁迫浓度的增加,叶绿素含量、可溶性蛋白含量、过氧化氢酶（CAT）活性、过氧化物酶（POD）活性、超氧化物歧化酶（SOD）等均呈现先上升、后下降的变化趋势。当ρ（V）≤12 mg·L-1,与对照相比较,叶绿素含量、可溶性蛋白含量和酶活性增大了135.3%、104.2%、77.8%（CAT）、84.5%（POD）和273.2%（SOD）;当ρ（V）〉12 mg·L-1,则分别降低37.2%、39.4%、41.1%、24.1%和24.5%。随着 V 胁迫浓度的增加,丙二醛（MDA）含量和细胞膜透性逐渐增大,与对照相比,分别增加了38.5%~289.3%、21.2%~303.2%,根系活力下降了10.9%~82.2%。可见,低ρ（V）（≤12 mg·L-1）对水稻幼苗的生长有一定的刺激作用,水稻幼苗自身保护酶表现出较强的自我调节能力;高ρ（V）（〉12 mg·L-1）明显抑制叶绿素和蛋白合成、抗氧化酶活性和根系活力,伤害了细胞质膜系统,影响水稻幼苗的生长发育。不同V浓度胁迫下,水稻幼苗累积的V含量为：根〉茎叶。随着V胁迫浓度增加,水稻幼苗各器官V含量增大,其中根部增幅远大于茎叶,当ρ（V）从5 mg·L-1增加到40 mg·L-1,与对照相比较,根部增加了0.98~25.3倍,茎叶部增加了0.26~4.74倍。生物富集系数（BF）先增加后降低,最大值为2.8408;迁移系数（TF）下降,最低值为0.1170,说明水稻对V有较强的富集能力,但迁移能力较低,积累的V主要富集在根部,可减轻V对地上部植物的危害。     

皇竹草对土壤阿特拉津的降解特性

为了探明种植皇竹草(Pennisetum hydridum)对土壤阿特拉津降解的促进作用,通过盆栽试验研究了皇竹草对土壤阿特拉津的降解动态、转移特征以及土壤阿特拉津残留浓度与土壤相关酶活性的关系。结果表明:与未种植皇竹草相比,种植皇竹草土壤阿特拉津降解率明显提高,皇竹草对未灭菌和灭菌土壤阿特拉津的降解率分别提高52.84和42.38百分点;与未种植皇竹草处理相比,灭菌和未灭菌条件下种植皇竹草处理阿特拉津在土壤中的半衰期可分别缩短64.35和53.21 d;土壤中阿特拉津被皇竹草吸收后逐步由地下部分向地上部分转移,随着培养时间的延长,转移系数变大;土壤中阿特拉津残留浓度与土壤过氧化氢酶、过氧化物酶、转化酶和多酚氧化酶活性呈显著负相关(P0.05或P0.01)。认为种植皇竹草有助于阿特拉津的降解。     

Comparison of growth and lipid accumulation properties of two oleaginous microalgae under different nutrient conditions

This study compared the growth and lipid accumulation properties of two oleaginous microalgae, namely, Scenedesmus sp. LX1 and Chlorella sp. HQ, under different nutrient conditions. Both algal species obtained the highest biomass, lipid content and lipid yield under low-nutrient conditions （mBGll medium）. The biomass, lipid content and lipid yield of Scenedesmus sp. LX1 were 0.42g·L^-1, 22.5% and 93.8mg·L^-1, respectively. These values were relatively higher than those of Chlorella sp. HQ （0.30g·L^-1, 17.1% and 51.3mg·L^-1, respectively）. These algae were then cultivated in an SE medium that contained more nutrients; as a result, the biomass and lipid yield of Scenedesmus sp. LX1 reduced more significantly than those of Chlorella sp. HQ. Opposite results were observed in lipid and triacylglycerols （TAGs） contents. The cell sizes of both algal species under low-nutrient conditions were larger than those under high-nutrient conditions. Chlorella sp. HQ cells did not aggregate, but Scenedesmus sp. LX1 cells flocculated easily, particularly under low-nutrient conditions. In summary, low-nutrient conditions favour the growth and lipid production of both algae, but Scenedesmus sp. LX1 outperforms Chlorella sp. HQ.     

Quantity and biochemical composition of sedimentary organic matter around offshore gas extraction platforms of the Adriatic Sea

Gas platforms can exert relevant effects on various ecosystem properties of the hosting area, modifying patterns of productivity and particle sedimentation. We hypothesised that the presence of gas platforms is associated with higher organic matter (OM) contents and we tested the null hypothesis by which benthic trophic conditions do not vary significantly among gas structures with different architectural characteristics. To test these hypotheses, we investigated sedimentary OM contents and biochemical composition at increasing distance from two distinct structures: one subsea well-site and one four-leg platform (FLP). We found that sediments surrounding the structures were characterised by similar OM contents, but different biochemical compositions, and that sedimentary OM compositional change with increasing distance from the structure is confirmed only at the FLP. These results suggest that: (i) benthic eutrophication is not consistent among different structures; (ii) OM biochemical composition changes are more evident than those in OM quantity; and (iii) the effect, wherever present, disappears at a very narrow distance from the platform. As biochemical composition of OM reflects food availability for benthic organisms, our results suggest that the enrichment of macrozoobenthic communities around these structures could be the consequence of increased nutritional quality of resources.     

Effect of the allelochemicals from the macrophyte Egeria densa on the competitive interactions of pelagic and littoral cladocerans

Macrophytes release allelochemicals, which affect pelagic cladocerans such as Daphnia. Using population growth experiments, we analysed the effects of allelochemicals from the macrophyte Egeria densa on the interaction between Daphnia mendotae and three littoral cladocerans (Diaphanosoma birgei, Macrothrix triserialis and Simocephalus mixtus). We found that allelochemicals from E. densa increased the abundance of all the tested cladocerans in spite of the presence of a competitor. This effect was stronger (nearly three to four times higher than in controls) for D. birgei and M. triserialis in the absence of D. mendotae. Independent of the presence of allelochemicals, S. mixtus, but not D. birgei and M. triserialis, reduced the abundance of D. mendotae as compared to controls. The rate of population increase (r) per day was significantly elevated due to the presence of Egeria’s allelochemicals (from 0.07–0.16?d^?1 without allelochemicals against 0.12–0.24?d^?1 with allelochemicals). In our competition experiments, the rates of population increase of the cladocerans were lower than those in single-species cultures when cultured in the absence of allelochemicals. However, in the presence of allelochemicals this trend was not consistent. Thus, the positive effects of Egeria’s allelochemicals over the cladoceran populations may enhance the grazing pressure on phytoplankton.