一例含阴离子水簇的钴配合物的合成、结构及理论研究

金属配合物中的水簇研究为研究宏观意义上的水以及与蛋白质分子有关的水分子提供了有效途径。本文合成了一个含有阴离子水簇的带状超分子配合物[Co(2,2-bipy)₂(N₃)₂](N₃)_0.5Cl_0.5·2H₂O(1,2, 2-bipy=2, 2-联吡啶)。单晶结构解析表明,配合物属于三斜晶系,P-1空间群,晶胞参数为:a=0.822 54(7) nm,b=1.175 58(9) nm,c=1.237 06(10) nm,α=91.379 0(10)°,β=92.151 0(10)°,γ=108.119 0(10)°,V=1.135 27(16) nm³,由一个单核[Co(2,2-bipy)₂(N₃)₂]⁺配合物阳离子、两个非配位水分子、0.5个游离的叠氮离子和0.5个氯离子组成,叠氮离子和氯离子位置无序,占有率各为50%。两个客体水分子通过强烈的分子间氢键作用形成了环状水四聚体,且与无序的N^-₃和Cl^-通过氢键作用形成了一个[(H₂O)₄(N₃)Cl]^2- 阴离子水簇。此外,本文基于密度泛函理论(DFT)对配合物[Co(2,2-bipy)₂(N₃)₂]⁺阳离子进行了量子化学计算,分析了其单点能和原子电荷,并计算了中心金属离子的氧化态,计算结果与实验相吻合。     

坝前淤泥土与新填坝体接触面抗剪强度试验研究及工程应用

坝前淤泥面与新填筑坝体接触面是"坝前淤泥面加坝"技术的薄弱环节.为了探究不同工况下淤泥坝基、新填筑坝体,以及淤泥土-新填土接触面的剪切强度特性,以宁夏南部山区西吉县南川水库坝前淤泥面加坝工程为研究对象,通过常规应变式直剪仪、改进常规应变式直剪仪分别进行剪切试验,分析了淤泥土含水率和压实度变化时,淤泥土、新填土、淤泥土-...     

Optimized Selection of Water Resource Allocation Schemes Based on Improved Connection Entropy in Beijing’s Southern Plain

Increased urbanization has caused problems such as increasing water consumption and the continuous deterioration of the groundwater environment. It is necessary to consider the groundwater quality in the water resource optimization system and increase the rate of reclaimed water development to reduce the amount of groundwater exploitation and achieve sustainable development of water resources. This study used the Daxing District, a region of Beijing’s southern plain, as an example to evaluate water quality by analyzing water quality data of surface and groundwater from 2012 to 2016 and actual water-use schemes from 2006 to 2016. Three groundwater extraction modes were set up based on NO₃–N concentrations, water resources were optimized under three extraction modes, and water resource optimization schemes were determined based on the improved connection entropy. The results show that (1) the surface water quality was poor, and the proportion of V₄ type water in the indexes of NH₃–N and chemical oxygen demand (COD) was the largest. The surface water can only be used for agricultural irrigation. The pollution sources contributing most to NH₃–N and COD were domestic and agricultural pollution sources. (2) The groundwater quality was good. The NO₃–N index was primarily type I–III water, accounting for 95.20% of the total samples. Severe NH₃–N pollution areas were mainly in the northern region, and most regional groundwater can be used for various purposes. (3) Taking 2016 as an example, three groundwater exploitation modes were set to optimize water resource allocation, and the results showed that the rate of groundwater development and NO₃–N pollution decreased significantly after optimization. (4) Connection entropy is an evaluation method that combines connection numbers and entropy, including identify, difference, and opposition entropy. As connection entropy being a kind of complete entropy, which can reflect the difference of the system in different states, based on the improved connection entropy, the connection entropies of optimal water resource allocation and actual water-use schemes were calculated. The connection entropy of groundwater exploitation mode 3 was less than that of groundwater exploitation modes 1 and 2 and actual water-use schemes from 2006 to 2016. Therefore, exploitation mode 3’s water resource optimization scheme was recommended. In the paper, satisfactory results have been obtained. As a kind of complete entropy, connection entropy has great research value in dealing with complex hydrological problems. This study’s research methods and outcomes can provide methodological and theoretical lessons for water management in freshwater-deficient areas.     

微珠析相微萃取-石墨炉原子吸收法测定岩石样品中痕量铬

采用二苯碳酰二肼为络合剂,正戊醇为萃取剂,乙醇为助溶剂,建立了微珠析相微萃取-石墨炉原子吸收法测定地质样品中痕量Cr的分析方法。实验详细探讨了微珠析相微萃取的析相条件、石墨炉原子吸收工作参数及共存离子的干扰,优化了体系萃取条件。实验结果表明：微珠析相微萃取既起到了分离富集的作用,在石墨炉升温程序中又起到了基体改进剂的作用;当萃取剂用量为0.2～1.5 mL时,使之与水完全互溶所需助溶剂体积约为水相体积的0.2～0.5倍;方法线性范围为0～10 μg·L-1,检出限为0.057 μg·L-1,相对标准偏差（RSD）为3.3%（c= 2.5 μg·L-1,n=11）;当萃取剂用量为1.5 mL、水相体积15 mL时,与直接溶液进样相比其灵敏度可提高10倍。所建立的方法用于地质标准参考物质AGV-2和G-2中Cr的测定,测定值与参考值具有较好的一致性。     

Water Status and Predictive Models of Moisture Content during Drying of Soybean Dregs Based on LF-NMR

To explore the drying characteristics of soybean dregs and a nondestructive moisture content test method, in this study, soybean dregs were dried with hot air (80 °C), the moisture content was measured using the drying method, water status was analyzed using low-field nuclear magnetic resonance (LF-NMR) and the moisture content prediction models were built and validated. The results revealed that the moisture contents of the soybean dregs were 0.57 and 0.01 g/g(w.b.), respectively, after drying for 5 and 7 h. The effective moisture diffusivity increased with the decrease in moisture content; it ranged from 5.27 × 10⁻⁹ to 6.96 × 10⁻⁸ m²·s⁻¹. Soybean dregs contained bound water (T₂₁), immobilized water (T₂₂) and free water (T₂₃ and T₂₃’). With the proceeding of drying, all of the relaxation peaks shifted left until a new peak (T₂₃’) appeared; then, the structure of soybean dregs changed, and the relaxation peaks reformed, and the peak shifted left again. The peak area may predict the moisture content of soybean dregs, and the gray values of images predict the moisture contents mainly composed of free water or immobilized water. The results may provide a reference for drying of soybean dregs and a new moisture detection method.     

固化疏浚泥作为填方材料的试验研究

港口、航道的建设和维护工程产生了大量的疏浚泥，如何处理这些疏浚泥已是国内外十分关注的问题．从资源的再生利用出发，提出利用固化材料固化疏浚泥作为填方材料的设想，并通过强度试验、溶出试验等一系列试验证实，固化疏浚泥作为填方材料在技术经济指标上完全可行．     

舟山渔场的水温分布特征分析

通过调查测得的数据分析了渔场水温的分布概况, 结果发现: 水平分布上, 无论冬夏, 渔场中北部始终存在1个低温区, 台湾暖流处(位置冬季偏东, 夏季偏西, 平均位置在124°E附近)存在高温水舌指向偏北, 冷暖水系交汇明显; 垂直分布上, 由于渔场岛屿众多, 海水混合作用强烈, 水温垂直梯度终年都很微弱, 即使在盛夏也很难形成强大的跃层.     

氨吸收式串联型动力/制冷复合循环

本文提出了一种新型的采用氨水混合工质的动力／制冷复合循环,该循环以中低温工业余热或燃气轮机排气为热源,将动力、制冷子循环采用串联方式连接,基础循环工质为氨质量浓度为0．27的氨水溶液,热源为365℃／104．3 kPa 的热空气,透平进气参数为350℃／3750 kPa,,以热效率η1、(火用)效率η2作为评价准则,模拟计算表明本循环的热效率η1 为17．8％,炯效率η2为45％,通过与其它有代表性的分供系统及联供系统进行热力性能方面的比较,表明本循环η1、η2均有不同程度提高。     

μs级充电时水介质同轴电容击穿实验研究

 研制了水介质同轴电容的实验装置，在此装置上进行了大量的实验。测得μs级充电时，水介质同轴电容分别在正脉冲和负脉冲充电时的击穿电压，负击穿电压的理论值与测量值相差较大，正击穿电压的理论值大于测量值的18%左右，对此实验结果进行了分析。此外，当去离子水的电阻率从13MΩ·cm降到5 MΩ·cm时，水介质同轴电容器的击穿电压基本不变。     

弯曲导管束在“水窗”及附近软X光的响应测量

测量了弯曲导管对“水窗”波段及其附近的X光响应,圆弧弯曲导管束对X光在“水窗”段有较大传输效率,而对“水窗”之外的高能X光响应较小,研究表明,X光在“水窗”段的响应,可以是在“水窗”之外的高能X光的响应的5倍,这种弯导管有可能用于同步辐射中,“过滤”掉白光高能部分,而直接输出较强的“水窗”段X光.