Density functional studies of the structural characteristics, Al NMR chemical shifts and water-exchange reactions of Al₃₀O₈(OH)₅₆(H₂O)₂₆(Al₃₀) in aqueous solution     

Zhaosheng Qian  Hui Feng  Wenjing Yang  Yingjie Wang 《Geochimica et cosmochimica acta》2010,74(4):1230-1032

In this paper, the structure of the Al₃₀O₈(OH)₅₆(H₂O)₂₆¹⁸⁺(Al₃₀) polyoxocation in aqueous solution is investigated, including an exploration of its water-exchange reaction using a supramolecular model. Thirty-one solvent water molecules were explicitly included in the supramolecular model to approximate the influence of the solvent. The calculated results indicated that both the gas-phase and the supramolecular models could correctly reproduce the structure of the Al₃₀ polyoxocation, but the supramolecular model described the structure more accurately. Using the supramolecular model, we calculated the ²⁷Al NMR chemical shifts of various aluminum atoms using HF and GIAO methods, and they compared well to the chemical shifts determined experimentally. The water-exchange reaction of the Al₃₀ polyoxocation could not be simulated with the gas phase model because of a proton-transfer reaction that is induced by the highly positive charge of the Al₃₀ polyoxocation. However, the inclusion of an explicit second solvation sphere lowered the acidity of the coordinated water molecules and allowed simulation of the water exchange reaction.  相似文献   

梭梭(Haloxylon ammodendron)主根周围土壤特征   总被引：1，自引：0，他引：1  

楚新正  马倩  马晓飞  徐莉  马婕 《中国沙漠》2014,34(1):170-175

通过建立米级的空间尺度进行分层取样,研究了准噶尔盆地南缘建群种——梭梭(Haloxylon ammodendron)主根周围土壤的含水率、容重、pH值、电导率和养分含量的变化状况。结果表明:(1)土壤含水量在表层5cm处最小,土壤容重在0~40cm土层变动幅度不大,但随着与茎基垂线距离的增加,二者出现显著变化(p0.05)。(2)土壤pH值和电导率在主根区周围呈现聚集现象,最大聚集率均在0~1m圈层,但随着距离的增加,土层深度逐渐成为主导因素。(3)土壤养分在表层5cm处聚集,但水平聚集范围中除有机质和全氮可扩增到3~4m外,全磷和速效养分均在0~2m。本研究结论对于荒漠区耐盐性植被的合理密植有一定的理论意义。  相似文献   

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�Ա�  ������  ����  ��ΰ  �Ųʺ�  ̷��  ����� 《大地测量与地球动力学》2014,34(5):178-182

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Optimization of calcium-based bioclogging and biocementation of sand   总被引：1，自引：0，他引：1  

Jian Chu  Volodymyr Ivanov  Maryam Naeimi  Viktor Stabnikov  Han-Long Liu 《Acta Geotechnica》2014,9(2):277-285

Bioclogging and biocementation can be used to improve the geotechnical properties of sand. These processes can be performed by adsorption of urease-producing bacterial cells on the sand grain surfaces, which is followed by crystallization of calcite produced from the calcium salt and urea solution due to bacterial hydrolysis of urea. In this paper, the effect of intact cell suspension of Bacillus sp. strain VS1, suspension of the washed bacterial cells, and culture liquid without bacterial cells on microbially induced calcite precipitation in sand was studied. The test results showed that adsorption/retention of urease activity on sand treated with washed cells of Bacillus sp. strain VS1 was 5–8 times higher than that treated with culture liquid. The unconfined compressive strength of sand treated with the suspension of washed cells was 1.7 times higher than that treated with culture liquid. This difference could be due to fast inactivation of urease by protease which was present in the culture liquid. The adsorption of bacterial cells on sand pretreated with calcium, aluminum, or ferric salts was 29–37 % higher as compared with that without pretreatment. The permeability of sand varied with the content of precipitated calcium. For bioclogging of sand, the content of precipitated calcium had to be 1.3 % (w/w) or higher. The shear strength of biotreated sand was also dependent on the content of precipitated calcium. To achieve an unconfined compressive strength of 1.5 MPa or higher, the content of precipitated calcium in the treated sand had to be 4.2 % (w/w) or higher. These data can be used as the reference values for geotechnical applications such as bioclogging for reducing the permeability of sand and biocementation for increasing the shear strength of soil.  相似文献   

南海海上搜救困难性评价     

左潇懿  程亮  楚森森  吴洁  张雪东 《热带地理》2022,42(7):1138-1147

为保障船舶海上航行安全,结合GIS与模糊层次分析法,从海上搜救的自然环境和人文搜救力量2个方面选取9个因子建立海上搜救困难性评价模型,对南海海上搜救困难性进行评价。结果表明：1）自然环境影响下,南海海域搜救困难性具有“V”字形分布的特点,由东北向西南难度等级逐渐降低。2）在人文搜救力量影响下,南海海域的搜救困难性整体呈“东北－西南条带式”,难度最大的区域主要位于南海东北―西南的连线上,呈不规则环状向连线两侧递减。3）综合两方面因素,南海部分岛屿周围搜救难度偏高,主要受台风等恶劣天气及远离搜救基地的影响,而远海海域搜救难度在整体上为“东北－西南递减式”空间分布格局,最高和较高的区域由研究区东北延伸至西南,然后向西北、东南两侧递减。总体而言,南海研究区中近21.1%的海域搜救难度≥7级,仍需加强对搜救力量的部署与建设。  相似文献   

Sentinel-1 SAR数据约束的2018年谢通门M_W5.8地震同震破裂模型     

倪乙鹏  聂兆生  熊维  陈威  余鹏飞 《大地测量与地球动力学》2021,41(6):589-594

通过Sentinel-1卫星升降轨数据获取谢通门地震的同震形变场,并基于均匀弹性半无限位错模型反演地震的同震滑动分布模型。InSAR同震形变场表明,升降轨视线向最大形变量分别为0.049 m和0.051 m,形变场长轴大致呈南北方向,位于甲岗-定结断裂西侧。通过对倾角和倾向进行格网搜索发现,西倾节面更可能为该地震的发震节面。反演结果表明,滑动分布主要位于2~10 km深度范围内,平均滑动量为0.02 m,最大滑动量为0.10 m,发震断层倾角为47°,平均滑动角为-81.60°,显示该地震以正倾滑动为主。大地测量数据约束的该地震震中为30.27°N、87.75°E,震源深度为6.58 km,释放地震矩为5.056×10¹⁷ Nm,对应矩震级为M_W5.7,与GCMT、USGS公布的震级基本一致。综合分析震中位置和滑动机制认为,甲岗-定结断裂的分支断层为本次谢通门地震的发震断层。  相似文献   

Coherent spectroscopy of a strongly driven triple quantum dot molecule     

解研  段素青  楚卫东  杨宁 《海洋学报(英文版)》2010,29(11)

Based on a calculation model, we study the interference phenomena of serially coupled V-type and Λ-type triple quantum dots (CTQDs) driven simultaneously by a strong driving field and a weak probe field. Strongly depending on the configuration of the three-level CTQD, the probe absorption spectra, which are shown in the tunneling current, exhibit various quantum coherence properties. In the case where the two pairs of transitions of the CTQD have a small eigenfrequency difference Δω, the double-coupling effect of the driving field results in two Autler-Townes doublets and one weak Mollow triplet in one spectrum. With the value of Δω increasing, only one Autler-Townes splitting remains due to the single-coupling of the field. We also find that the effect of spontaneous emission of phonons may lead to an obvious background current, which can be used to distinguish which transition is driven by the driving field in experiment. The interesting quantum property of a CTQD revealed in our results suggests its potential applications in quantum modulators and quantum logic devices.  相似文献   

The influence of water retention curve hysteresis on the stability of unsaturated soil slopes     

Kuo‐Chen Ma  Yih‐Chi Tan  Chu‐Hui Chen 《水文研究》2011,25(23):3563-3574

Hysteresis is a common feature exhibited in hydraulic properties of an unsaturated soil. The movement of wetting front and the hysteresis effect are important factors which impact the shear strength of the unsaturated soil and the mechanics of shallow landslides. These failures are mainly triggered by the deepening of the wetting front accompanied by a decrease in matric suction induced by infiltration. This research establishes a method for determining a stability analysis of unsaturated infinite soil slopes, integrating the influence of infiltration and the water retention curve hysteresis. Furthermore, the present stability analysis method including the infiltration model and the advanced Mohr–Coulomb failure criterion calculates the variations of the safety factor (FS) in accordance with different slope angle, depth and hydrological processes. The experimentally measured data on the effect of hysteresis are also carried out for comparison. Numerical analyses, employing both wetting and drying hydraulic behaviour of unsaturated soil, are performed to study the difference in soil‐water content as observed in the experiments. The simulating approximations also fully responded to the experimental data of sand box. The results suggest that the hysteresis behaviour affect the distribution of soil‐water content within the slope indeed. The hysteresis made the FS values a remarkable recovery during the period of non‐rainfall in a rainfall event. The appropriate hydraulic properties of soil (i.e. wetting or drying) should be used in accordance with the processes that unsaturated soil actually experience. This method will enable us to acquire more accurate matric suction head and the unsaturated soil‐shear strength as it changes with the hysteretic flow, in order to calculate into the stability analysis of shallow landslides. An advanced understanding of the process mechanism afforded by this method is critical to realizing a reliable and appropriate design for slope stabilization. It also offers some immediate reference information to the disaster reduction department of the government. Copyright © 2011 John Wiley & Sons, Ltd.  相似文献   

Recombination induced softening and reheating of the cosmic plasma     

P. K. Leung  C. W. Chan  M.-C. Chu 《Monthly notices of the Royal Astronomical Society》2004,349(2):632-640

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LBQS类星体样品球空间功率谱分析     

陶建辉  褚耀泉 《天文学报》1994,35(3):264-273

本文用球空间功率谱分析方法研究了ＬＢＱＳ类星体样品的成团性，讨论了ｑ０、边界效应、红移测量误差的影响，并与相关函数的结果进行了比较，认为本样品类星体是不成团的或极弱成团。  相似文献