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X射线和中子散射是互补的液态结构研究的有效方法。通过数据解析可提取偏径向分布函数(PDF)、配位数分布(CN)、角分布(ADF)及空间密度分布(SDF)等,从而给出溶液在原子层次上的三维结构信息。介绍了利用X射线和中子散射研究溶液结构的实验及数据解析方法,回顾了近些年研究团队利用该方法在纯水结构、硼酸盐水溶液结构及溶液中"二氢键"等研究中的应用。简述了X射线及中子散射在溶液结构研究中存在的问题,并展望了上述方法在溶液结构研究中的发展方向。 相似文献
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以盐湖卤水为原料提取并制备Li2CO3的过程中,共存离子对其结晶过程影响较大,尤其西藏盐湖卤水为原料制备碳酸锂的原料中,K/Li约为0.3左右,所以研究K+对Li2CO3晶体的影响具有重要意义。本研究通过实验和计算模拟相结合研究不同K/Li条件下K+对Li2CO3晶体的影响程度,建立晶体中K+含量与比表面积关联式。实验结果表明,K+的存在对Li2CO3的高品质性影响较大,且随着钾离子含量增加,晶体比表面积增大易于吸附杂质离子,表面粗糙度增强,且K+存在对碳酸锂晶体的收率影响较大,而当K/Li控制在0.1以内时,K+对碳酸锂晶体的影响相对较小;通过第一性原理计算,计算并分析了K掺入碳酸锂晶体中的几何结构、缺陷形成能及态密度,结果表明K原子在碳酸锂晶体中更易替代晶体中的Li原子,且K原子的掺入对碳酸锂晶体的晶格参数以及电子结构性质的影响较小。本文对西藏盐湖高效提锂和制备高附加值碳酸锂晶体提供理论依据。 相似文献
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采用支持向量机对具有RGB 3个波段、分辨率为0.32 m的航空摄影图像进行实验,首次根据表示空间聚集程度的局部Getis因子完成分类。结果表明:1)当应用基于线性、多项式、径向基和Sigmoid 4种常用核函数的SVM进行分类时,基于径向基的SVM分类精度最高,总体精度超过91%。2)从原始图像计算出局部Getis因子,该指标可用于图像分类,且分类精度与局部Getis因子的步长有关;在步长小于变异函数变程的条件下,应用径向基SVM的总体分类精度达95.66%,高于直接使用原始图像RGB波段光谱信息的分类精度,因此局部Getis因子在高空间分辨率遥感图像分类中具有应用和研究价值。 相似文献
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以盐湖卤水为原料提取并制备Li2CO3的过程中,共存离子对其结晶过程影响较大,尤其我国西藏盐湖卤水为原料制备碳酸锂的原料中,K/Li约为0.3左右,所以研究K+对Li2CO3晶体的影响具有重要意义。通过实验和计算模拟相结合研究不同K/Li条件下K+对Li2CO3晶体的影响程度,建立晶体中K+含量与比表面积关联式。实验结果表明,K+的存在对Li2CO3的高品质性影响较大,且随着钾离子含量增加,晶体比表面积增大易于吸附杂质离子,表面粗糙度增强,且K+存在对碳酸锂晶体的收率影响较大,而当K/Li控制在0.1以内时,K+对碳酸锂晶体的影响相对较小。通过第一性原理计算,计算并分析了K掺入碳酸锂晶体中的几何结构、缺陷形成能及态密度,结果表明K原子在碳酸锂晶体中更易替代晶体中的Li原子,K原子的掺入对碳酸锂晶体的晶格参数以及电子结构性质的影响较小。对西藏盐湖高效提锂和制备高附加值碳酸锂晶体提供了理论依据。 相似文献
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以阿坝藏族羌族自治州地质灾害频发的理县为研究区,从地形地貌、地质环境、水文条件和人类工程活动等方面选取11个影响因子,通过皮尔森相关系数研究各因子之间的相关性,从而构建滑坡易发性评价指标体系。利用信息量模型计算各影响因子的信息量值,从信息量模型得出的极低和低易发性分区中选取非滑坡样本,在此基础上将样本数据代入随机森林和径向基函数神经网络2种机器学习模型开展滑坡易发性评价,并通过接收灵敏度（Receiver Operating Characteristic,ROC）曲线进行精度验证。结果显示：随机森林模型预测出的高易发区单位面积内分布的滑坡点数量更为集中,在仅占6.666%的区域分布了74.026%的灾害点,评价结果优于径向基函数神经网络模型。ROC曲线中两模型AUC（Area Under Curve）值分别为0.893、0.874,说明随机森林模型具有更高的可靠性,比径向基函数神经网络在该区域地质灾害易发性评价中更具优势。 相似文献
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在地理空间中各种地理现象实际上是一种连续变化的空间场。由于受到观测手段、工具的限制,只能从有限的地点获得有限的观测数据。为了获得连续的空间场,通常采用克吕格插值、反距离权重插值等方法进行重建。但这些方法都是各向同性的,与具有各向异性的真实地理现象分布并不相符。该文以各向同性的紧支撑径向基函数插值模型为基础,对其进行改进,使其能够顾及空间场的各向异性。其方法是利用加权主成分分析对原始数据进行方向性特征分析并进行旋转,再利用半变异函数拟合变换后坐标系下各轴向的变程值,以此为基础构建紧支撑径向基函数插值模型并进行插值,最后将插值结果逆旋转到真实地理空间。以国家气象中心提供的黄淮海平原气温数据与香港天文台提供的香港地区气温数据为例,对该文提出的顾及各向异性紧支撑径向基函数空间插值方法进行验证,并与反距离权重插值、全局径向基函数插值及顾及各向异性的普通克里格插值进行对比,实验表明该方法具有较高的精度且能够对气温场的细节进行准确的重建。 相似文献
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我国生物修复技术的现状与展望 总被引：22，自引：2，他引：20
环境问题是当前人类生存与发展过程中所面临的重大问题。生物修复技术是解决环境污染,恢复被人类活动破坏的生态系统,实现人类社会可持续发展的重要手段之一。近年来,我国生物修复技术研究与应用蓬勃发展,取得了显著成绩。其内容主要包括微生物修复技术、重金属污染的植物修复技术、矿山废弃地生态恢复技术、固体废弃物资源化技术、垃圾填埋场生态修复技术及湖沼生态恢复技术等。在高效特异微生物与重金属超富集植物筛选及其机理研究上取得了一系列的突破,已筛选出近50种针对农药、石油、多环芳烃等有机污染物的高效特异菌种和As、Cd、Mn、Zn等12种重金属的超富集植物。今后应注意吸收其他学科的理论知识,拓宽研究领域,注重生物修复的机理研究及相关分子生物学技术的开发与应用;开展全国范围的环境污染调查与风险评估工作;建立污染环境修复的法规与标准;从而促进生物修复技术的持续发展,为国民经济发展及环境与健康保护服务。 相似文献
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湖泊沉积记录在区域千年气候与环境变化方面的应用近年来发展迅速,成果令人瞩目。保存在各类湖泊岩芯中的气候指标如孢粉组合、地球化学元素、分子同位素、有机质色素、生物标志物等被广泛应用到气候因子的重建工作中。研究方法的改进、测年精度的提高、环境指标与气候因子之间的定量转换是今后湖泊沉积千年以来高分辨率研究的需要,此外还要重视加强多项环境指标的综合研究,寻求其它有效环境替代指标以及开展不同类型湖泊环境代理记录的对比研究。 相似文献
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Joseph R. Oppong Curtis J. Denton Patrick K. Moonan Stephen E. Weis 《The Professional geographer》2007,59(4):478-491
Regardless of destination, immigrants arrive with health profiles typical of people in their previous surroundings. Thus, immigrants change the epidemiological profile of destination communities, and immigrant neighborhoods may represent islands of infectious disease. Genotyping has emerged as a useful surveillance tool to track the spread of disease at the molecular level. Yet the spatial distribution of infectious disease at the molecular level associated with migration and immigrant neighborhoods has received little attention. Using molecular genotyping to characterize M. tuberculosis isolated from tuberculosis cases, this article analyzes spatial variations of unique molecular M. tuberculosis strains by zip code in Tarrant County, Texas. The results suggest that immigrant neighborhoods have higher rates of unique isolates of tuberculosis (suggestive of remote transmission) compared to neighborhoods occupied by the native‐born. Neighborhoods dominated by the native‐born have higher rates of clustered isolates (suggestive of recent transmission). Therefore, in addition to being culturally distinct, immigrant neighborhoods may also be pathogenically distinct from surrounding neighborhoods. 相似文献
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Food security in cold and arid regions in the world is threatened by stressful and unpredictable environments.The sus-tainable and economically viable solution for increasing stability of food productivity in cold and arid regions is genetic improvement of crops towards high resistance to abiotic stresses,mainly cold and drought resistance.It is often empha-sized that crop genetic improvement lies in exploiting the gene pools of the wild relatives of the crop plant.Wild barley,H.spontaneum,the progenitor of cultivated barley,is a selfing annual grass of predominantly Mediterranean and Irano-Turanian distribution that penetrates into desert environments where it maintains stable populations.Wild barley is also found in cold regions,such as in Tibet.The adaptation of wild barley to the arid region in Israel and Jordan,and the cold region in Tibet has accumulated rich genetic diversities for drought,salt,and cold resistances in wild barley,which is the genetic resource for barley and other crop improvement in arid and cold regions.These genetic diversities are revealed by allozymes,DNA-based molecular markers,and morphological and physiological traits of wild barley plants.Quantita-tive trait loci(QTLs) related to drought resistance were identified in wild barley via the QTL mapping approach.Drought resistance genes such as dehydrins,hsdr4,and eibi1 were identified in wild barley based on the candidate gene approach,gene differential expression approach,and molecular genetic approach,respectively.Genetics and genomics of wild bar-ley cold resistance have not been exploited yet,remaining a huge treasure for future crop improvement of cold resistance.Advanced backcross QTL analysis,the introgression libraries based on wild barley as donors,a QTL approach based on wide crosses using wild barley,and positional cloning of natural QTLs will play prevailing roles to help us understand the molecular control of cold and drought tolerance.Integration of QTL information into a breeding pipeline aimed at im-proving tolerance t 相似文献
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本文报道南极海洋冷水环境中的低分子挥发性脂肪酸的一种测定方法 ,阐述高压液相色谱法对海洋环境中 C1- C5年低分子挥发性脂肪酸的含量测定具有较好的适用性 ,说明该方法具有正确、灵敏、操作简单、快速及需要样品量少等特点。本方法的最低检测限在 0 .1 μg/ml以下 ,个别酸如丙烯酸可达 0 .0 0 1μg/ml以下。南极戴维斯站附近沿海 ,1 989年 1月 3日 6 0 m水柱体样品测定结果丙烯酸为 0 .0 0 4 - 0 .0 4 2 μg/ml,其他酸是 0 .1 - 1 .0 μg/ml,说明了该方法完全可满足实际海水样品的分析。 相似文献
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Li2SO4溶液中离子间的缔合相互作用:基于密度泛函理论和分子动力学模拟的研究 总被引：1，自引：1，他引：0
基于密度泛函理论,使用B3LYP/aVDZ方法对[Li_2SO_4(H_2O)_n]~0(n=0~10、18)水合团簇的结构和性质进行了系统地研究,并结合Car-Parrinello分子动力学(CPMD)模拟了不同浓度的Li_2SO_4溶液结构,目的在于理解在Li_2SO_4溶液中离子间缔合相互作用及可能存在的物种。研究发现,对于[Li_2SO_4(H_2O)_n]~0(n=0~10、18)水合团簇,双配位单齿螯合接触离子对结构比双配位双齿螯合接触离子对结构更稳定,溶剂共享离子对结构最不稳定。同时,CPMD模拟结果表明,在3.09和3.17 mol/kg的Li_2SO_4溶液中,双配位单齿螯合接触离子对结构仍然是主要物种。以上结果表明在饱和的Li_2SO_4溶液(3.16 mol/kg)中,Li~+和SO_4~(2-)离子间的相互缔合作用主要以双配位单齿螯合接触离子对结构的物种存在,而具有双配位双齿螯合离子对结构的物种占少数,溶剂共享离子对结构几乎不存在。 相似文献
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Cinzia Verde Ennio Cocca Donatella de Pascale Elio Parisi Guido di Frisco 《Polar research》2004,23(1):3-10
The climatic features of Antarctic waters are more extreme and constant than in the Arctic. The Antarctic has been isolated and cold longer than the Arctic. The polar ichthyofaunas differ in age, endemism, taxonomy, zoogeographic distinctiveness and physiological tolerance to environmental parameters. The Arctic is the connection between the Antarctic and the temperate-tropical systems. Paradigmatic comparisons of the pathways of adaptive evolution of fish from both poles address the oxygen-transport system and the antifreezes of northern and southern species, (i) Haemoglobin evolution has included adaptations at the biochemical, physiological and molecular levels. Within the study of the molecular bases offish cold adaptation, and taking advantage of the information on haemoglobin amino acid sequence, we analysed the evolutionary history of the α and β globins of Antarctic, Arctic and temperate haemoglobins as a basis for reconstructing phylogenetic relationships. In the trees, the constant physico-chemical conditions of the Antarctic waters are matched by clear grouping of globin sequences, whereas the variability typical of the Arctic ecosystem corresponds to high sequence variation, reflected by scattered intermediate positions between the Antarctic and non-Antarctic clades. (ii) Antifreeze (glyco)proteins and peptides allow polar fish to survive at sub-zero temperatures. In Antarctic Notothenioidei the antifreeze gene evolved from a trypsinogen-like serine protease gene. In the Arctic polar cod the genome contains genes which encode nearly identical proteins, but have evolved from a different genomic locus–a case of convergent evolution. 相似文献
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The Chinese yew (Taxus wallichiana), which is widely distributed in the Himalayas and in southern China, is now on the edge of extinction. In order to understand the evolutionary processes that control the current diversity within this species at the genetic and ecological levels, its genetic patterns and range dynamics must first be identified and mapped. This knowledge can then be applied in the development of an effective conservation strategy. Based on molecular data obtained from 48 populations of T. wallichiana, we used GIS-based interpolation approach for the explicit visualization of patterns of genetic divergence and diversity, and a number of potential evolutionary hotspots have been specifically identified within the genetic landscape maps. Within the maps of genetic divergence and diversity, five areas of high inter-population genetic divergence and six areas of high intra-population genetic diversity have been highlighted in a number of separate mountain regions, and these evolutionary hotspots should have the priority to be protected. Furthermore, four geographical barriers have been identified: the eastern Himalayas, the Yunnan Plateau, the Hengduan Mountains and the Taiwan Strait. According to ecological niche modeling (ENM), the populations of T. wallichiana within the Sino-Himalayan Forest floristic subkingdom experienced westward expansion from the periods of Last Inter-glacial to Last Glacial Maximum (LGM). Following the LGM, the distribution range overall became reduced and fragmented. These findings challenge the classic mode of contraction-expansion in response to the last glaciation. In conclusion, our findings suggest that the changes in geographical landscapes and climate that occurred during the Quaternary resulted in current genetic landscape patterns. 相似文献
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Sub-surface precipitation of salts in supercritical seawater 总被引：2，自引：0，他引：2
Martin Hovland Tatyana Kuznetsova† Håkon Rueslåtten‡ Bjørn Kvamme† Hans Konrad Johnsen¶ Gunnar E. Fladmark§ Andreas Hebach† 《Basin Research》2006,18(2):221-230
Extremely low solubility of typical seawater salts within certain supercritical sections of their pressure–temperature composition space is a proven experimental fact. Its consequences are often referred to as either 'shock crystallization' or 'out-salting'. Our alternative model for the formation of salt deposits hypothesizes that high temperatures and pressures characteristic for the high heat-flow zones of tectonically active basins may bring submarine brines into the out-salting regions and result in the accumulation of geological-scale salt depositions.
To confirm the laboratory observations, molecular-scale simulations (molecular dynamics) have been employed to study structural changes in a model seawater system where temperature increased from ambient to near-critical and supercritical. Fluid properties and phase transition regions extracted from the simulations were then used as input parameters for a reservoir simulator program to model out-salting in a simple hydrothermal geological system. Both numerical simulations and laboratory experiments confirm that supercritical out-salting is a viable process of geological significance for the formation and accumulation of evaporites. We suggest two regions where hydrothermally associated salts may be depositing today: Atlantis II Deep, in the Red Sea, and Lake Asale, Ethiopia. 相似文献
To confirm the laboratory observations, molecular-scale simulations (molecular dynamics) have been employed to study structural changes in a model seawater system where temperature increased from ambient to near-critical and supercritical. Fluid properties and phase transition regions extracted from the simulations were then used as input parameters for a reservoir simulator program to model out-salting in a simple hydrothermal geological system. Both numerical simulations and laboratory experiments confirm that supercritical out-salting is a viable process of geological significance for the formation and accumulation of evaporites. We suggest two regions where hydrothermally associated salts may be depositing today: Atlantis II Deep, in the Red Sea, and Lake Asale, Ethiopia. 相似文献