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Density Functional Theory method was used to optimize the geometries of 209 PCDE molecules, 209 PBDE molecules and 75 PCDD molecules at the B3LYP/6-31G* level. Using computed structural parameters as theoretical descriptors, the forward stepwise multiple regression technique was adopted to obtain QSPR models of environmental partition properties for these POPs by using GQSARF 2.0 and SPSS12.0 for windows programs. The obtained QSPR models are as follows:(1) QSPR models for predicting subcooled liquid vapor pressure, n-octanol/water partition coefficients lgK_(ow and subcooled liquid water solubilities -lgS_(w,l of PCDEs, of which correlative coefficients (R~2) are 0.988, 0.958 and 0.959 and the root-mean-square-error of estimation are 0.134, 0.116 and 0.327 respectively.(2) QSPR models of lgPL and n-octanol/air partition coefficients lgK_(oa for PBDEs, which both contain three structural parameters. The values of R2 for the two models are both 0.997 while the values of RMSEE are 0.073 and 0.062 respectively.(3) QSPR models of lgKow and–lgS_ for PCDEs, which both have one variable (mean molecular polarizability,α). The values of R~2 for the two models are 0.978 and 0.866 and the values of RMSEE are 0.300 and 0.270 respectively.(4) The molecular structures of 24 substituted naphthaline compounds were optimized using Hartree-Fock and DFT methods at four different levels and the same means was used to obtain four three-parameter (EHOMO, q~+ andα) QSPR models of lgK_. The model at the HF/6-311G** level is the best one of which R2 is 0.9662 and RMSEE is 0.380.(5) QSPR study for environmental partition properties of PCDEs was also performed using position of Cl substitution method in which simple parameters of substitution position were taken as descriptors. The multiple linear regression was performed with GQSARF 2.0 and SSPS 12.0 for windows programs to obtain QSPR models of lgP_L, lgK_ and–lgS_ for PCDEs of which R~2 are 0.991, 0.983 and 0.965 and RMSEE are 0.311, 0.100 and 0.300 respectively.
采用密度泛函理论方法在B3LYP/6-31G*水平上对PCDEs、PBDEs和PCDDs的分子结构进行了全优化计算,以计算得到的量子化学参数作为理论描述符,采用GQSARF 2.0和SPSS 12.0 for windows统计程序进行正向逐步回归分析,建立了这些POPs的环境分配性质的QSPR模型:(1) PCDEs的过冷液体蒸汽压、正辛醇/水分配系数lgK_(ow和水溶解度-lgS_(w,l的QSPR模型,这3个QSPR模型的相关系数(R2)分别为0.988、0.958和0.959,估计的均方根误差分别为0.134、0.116和0.327;(2) PBDEs的lgPL和正辛醇/空气分配系数lgK_(oa的QSPR模型,这两个模型都包含三个分子结构参数,其R~2都为0.997,RSMEE分别为0.073和0.062;(3) PCDDs类化合物的lgK_和-lgS_w的QSPR模型,两个模型都只含一个变量,其R~2分别为0.978和0.866,RSMEE分别为0.300和0.270;(4)采用Hartree-Fock和DFT方法,在4种不同水平上优化计算了24个取代萘系列化合物的分子结构,采用上述同样的方法分别建立了四种水平上的三变量lgK_模型,通过比较得到,在HF/6-311G**水平计算得到的模型最好,R为0.966,RSMEE为0.380;(5)同时,采用氯原子取代位置方法对PCDEs的环境分配性质进行QSPR研究,建立了PCDEs的lgPL、lgK_和-lgS_的QSPR模型,其R~2分别为0.991、0.983和0.965,RSMEE分别为0.110、0.100和0.300。
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The new opinion and mechanism that the simultaneously adsorption of complex pollution of both organic and heavy metals will be achieved on soil modified with amphoteric surface modifying agent, which have both charged group and organophilic group on one ASMA molecule, were proposed at first time, and its rationality was testified at the same time; The 50% was the critical CTMAB modifying ratio of soil CEC at which the organophilic bond modifying mechanism was emerged; The thermodynamic characteristics of adsorption of OPT and HMP on OMS were discovered ; The study revealed the surface peculiarity of OMS that the modifying agent were distributed at uneven scatter mode and multi-characters surface were coexisted on surface of OMS, revealed the adsorption peculiarity of OMS that multi-mechanisms were coexisted, confirmed the unequal charge amount modifying mode of OMS in which dual-modifying mechanism of both ion exchange and OPB were processed at the same time, and confirmed that the adsorption hobby to CTMAB was higher than that to Ca2+ on Lou soil.
首次提出了用两性表面修饰剂对土壤进行修饰改性,利用两性表面修饰剂所具有的荷电基团和疏水基团达到对土壤中有机、重金属污染物同时吸附的思路和机理,并通过实验证实了所提设想的合理性;发现了土壤CEC值的50%修饰比例是CTMAB开始显现以疏水键机制对土土样表面进行修饰的临界点;揭示了有机修饰改性土对有机物、重金属吸附过程的热力学特征,填补了该项研究工作的空白;阐明了修饰剂在改性土表面呈分散态的非均匀分布,改性土表面具有不同性质表面共存的表面特征和对污染物多机制共存的吸附特征,确定了阳离子表面修饰剂在土表面的修饰是一种离子交换和疏水键结合两种机制相伴并行且为非等电荷量交换的修饰反应模式,以及土具有对CTMAB的吸附偏好性远大于对钙离子吸附偏好性的特征。
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In subliminal affective priming task, there were no significant differences of correct rates and latencies between alexithymic and nonalexithymic,while on the both two SOA levels (200ms and 300ms) of supraliminal priming task, the mean response latencies of alexithymic were longer than those of nonalexithymic.(4) In both subliminal and supraliminal affective priming tasks, P2 and P3 were elicited by both alexithymic and nonalexithymic during performing the affective priming task.
情绪启动效应早期的ERPs特征表现为启动条件和非启动条件的P2潜伏期均显著短于控制条件的P2潜伏期,而P2波幅则显著大于控制条件的P2波幅,这种效应在顶区表现得尤其明显;情绪启动效应晚期的ERPs特征表现为启动条件P3潜伏期显著短于非启动条件的P3潜伏期,而P3波幅显著小于非启动条件和控制条件的P3波幅,这种差异也主要见于顶区。
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Results We isolated 2 strains of Bdellovibrio sp.(5#-12 and 5#-sh06) from sea mud of Shenzhen bay. Both strains grew between 20℃ and 35℃, with 25℃ and 30℃ as optimal temperature for 5#-12 and 5#-sh06, respectively. They grew between pH 6.1 and 8.6, and the opti℃mal pH for both was 7.2. Lysis experiments on 58 strains of pathogens were conducted and the results showed that 5#-12 and 5#-sh06 lysed 46 and 48 strains, corresponding to 79.3% and 82.8% of lysis abilities. Taken both two Bdellovibrio strains together, they lysed 96.6%(56 strains) of tested pathogens and 100% of tested vibrios (39 strains).
从深圳湾海泥中分离出2株蛭弧菌,分别命名为5#-12和5#-sh06,它们可在20℃~35℃范围内生长,最适温度分别是25℃和30℃;生长pH范围6.1~8.6,最适pH均为7.2;2株蛭弧菌可分别裂解46和48株试验菌,各占总试验菌株数(58)的79.3%和82.8%;联合2株蛭弧菌,可裂解56株试验菌,占总试验菌株数的96.6%;同时,它们一起能将所有试验弧菌裂解。
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The ion concentrations were studied in both four snow pits on Hami Miaoergou FlatTopped Glacier and one snow pit on Haxilegen Glacier No.51 of Kuitun river in eastern Tianshan Mountain, and both snow pits were retrieved in 2004. The results show that the Ca2+, NO-3 and SO2-4, particularly Ca2+, are major ions in the snow of snow pits in both ablation and accumulation area and also in the ice of snow pits in accumulation area on Hami Miaoergou FlatTopped Glacier, where the relationships among major cation concentrations in snow of snow pits can be revealed by ion concentrations in the ice of snow pits, but the correlation between ion concentrations in the snow of snow pits and elevation is not obvious, which probably can be attributed to the narrow span of elevation and sparse snow pits on glacier. However, the good correlation between ion concentrations in the ice of snow pits and elevation indicates that the elution process weakened gradually with the elevation rise and temperature decrease.
对2004年获取的天山奎屯河哈希勒根51号冰川1个雪坑和哈密庙尔沟平顶冰川4个雪坑的离子浓度特征进行了研究,结果表明:Ca2+、NO-3和SO42-是哈密庙尔沟平顶冰川雪坑雪层和积累区雪坑底部冰中的主要离子(尤其是Ca2+),其雪层中的主要阳离子关系可在底部冰中得以较好的反映,但雪层中各离子浓度与海拔的相关性不明显,可能与海拔的跨度较小和挖取的雪坑较疏有关;雪坑底部冰中的离子浓度与海拔间明显的相关性说明淋融作用随着海拔升高、气温降低而逐渐减弱。
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The plasma ignition threshold of metal is got through experimental and numerical study. The vapour and plasma ignition times of the target are got based on the equation of heat conduction and cascade model. We suppose that the plasma is ignited when generations of new electrons are born in vapour generation time. The influence of temperature on the thermodynamics and optics parameters of material also have been considered in the model. The resulting theory has good agreement with the experiment and overseas report. A blade method to measure the laser spot is given in this paper with validation and error analysis. The plasma threshold of metals in atmosphere and water ambients both are diagnosed with the light deflection and piezoelectric transducer. A Q-switched pulsed Nd:YAG laser operating at infrared (1064nm), visible(532nm) and ultraviolet (355nm) wavelengths has been used. Al、Fe、Cu are used as targets and get a similar results with both method. Theoretical and experimental analyses are applied on the influence of wavelength on the threshold have been done, both of which have shown that the plasma threshold of metals decrease as the laser wavelength increases; The plasma threshold of metals are higher in water than in air and the pressure of the shock wave in water is five times higher than in air .
从热传导方程和雪崩电离机制出发,假设当电子增值210倍时,考虑了温度对材料热力学和光学参数的影响时,得到了气化和等离子体点燃的时间,利用该模型进行计算得到的结果与国内外报道及自行通过实验测得的阈值基本一致;提出了利用刀刃法测量激光光斑面积的方法,并通过实验进行了验证和误差分析;利用光偏转装置和压电换能器分别对空气和水中金属等离子体点燃阈值进行了实验诊断,激光器均为调Q-YAG激光器(波长1064nm,532nm,355nm,脉宽10ns),靶材分别为Al、Fe和Cu,两种测试方法得到的等离子体点燃阈值基本一致;本文从实验和理论计算两个方面讨论了波长对等离子体点燃阈值的影响,均得到了等离子体点燃阈值随著波长的增加而减小的结论;对空气中和水中不同环境下金属等离子体的点燃阈值进行了比较研究,得到了金属在水中的等离子体点燃阈值比空气中的大,且水中产生的冲击波的压强是空气中的5倍左右的结论。
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Moreover, with regard to each and all provisions and collations of ecclesiastical benefices, confirmations of elections and petitions, grants of concessions, mandates and indults, of whatever kind, concerning both favours and matters of justice or both together, of whatever sense they may be -- which things we wish to be regarded as clearly stated in the present letter -- which were made by the synagogue or quasi-council of Pisa and its schismatic adherents, lacking all authority and merit, though they are indeed null and void, yet, for greater caution, we decree, with the approval of the said sacred council, that they are null and of no effect, force or importance; and that each individual, of whatever rank, status, grade, nobility, order or condition, to whom they were granted, or to whose convenience, advantage or honour they pertain, are to give up their fruits, incomes and profits, or to arrange for this to be done, and they are bound to restore both these things and their benefices and to give up the other aforesaid concessions, and that unless they have really and completely given up the benefices themselves and the other things granted to them, within two months from the date of this present letter, they are automatically deprived of the other ecclesiastical benefices which they hold by lawful title.
此外,关於每一个和所有条款和校对的教会benefices ,确认选举和请愿书,赠款的让步,任务和indults ,无论那种,都倾向於和有关事项的司法或两者一起,无论他们可能是意义-这是我们希望被看作是中明确指出本信-这是由犹太教堂或准安理会比萨及其分裂的信徒,都缺乏权威和价值,但它们实际上是无效的,但,有更大的谨慎,我们法令批准,该理事会表示,神圣的,他们是完全没有效果,武力或重要性和每一个人,无论职位高低,身份,等级,贵族,命令或条件,以他们被授予或其方便,优势或履行它们涉及,是放弃自己的水果,收入和利润,或安排这样做,他们的约束,以恢复这些事情都和他们的benefices和放弃其他上述让步,除非他们真正和彻底放弃benefices自己和其他的东西给他们,在两个月内之日起的本信,他们会自动被剥夺了其他教会benefices他们搁置的合法所有权。
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The compatibility of both Gvirens and B.firmus was researched. The fermentation filtrate of Gvirens , under the concentration of 70%, had not distinct inhibitory activity to B.firmus, the biomass of B.firmus would decrease with above the 70% filtrate of Gvirens, but the fermentation filtrate of B.firmus had not inhibitive role to Gvirens. 7, The cooperation control of both Gvirens and B.firm to the pine needle blight was explored:(1) Pathogen inoculation happened prior to the bio-control treatment for 7 days, however, the disease index and control effect had not distinct differences in any treatments even if combination of the two antagonists, but the susceptibility for different kind of pine were different.(2)when antagonist and pathogen were inoculated at the same time, some control effect to the pine needle blight, including certain extent cooperation control of both Gvirens and B.firm were proved, but it wasn't distinct when two antagonists used separately, and the change of the antagonist concentration had little effect to the control effect.
G.virens与B.firmus对松赤枯病的协同控制显示:(1)预先接种病菌后(7天)再进行生物防治处理,不管那种情况,感病指数和防治效果在处理间差异不明显,浓度影响无显著差异,即使是两种生防制剂联合作用也未显著提高其防效,但不同树种间的感病性有明显差异;(2)领抗菌与病原菌同时接种,对松赤枯病有一定防治效果,两菌联合有一定的协同作用,两菌分别单独施用防效差异不显著,浓度变化对防效影响不大;(3)预先接种颇抗菌能显著提高防治效果,两菌联合处理防效更优,感病树种的感病指数可降至13一15,抗病树种的感病指数可控制在3%左右;在同一浓度下B.f1'r功US、叹叮厂即s间无显著差异,在同一领抗菌下,浓度愈高,防效愈高:松,(4)三种生防接种方式的平均效果分析表明,叹F行ens最高平均防效49.5%黑 B。
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Such doubts havesitimulated the researchers'curiosity and start to explore the students' terms This research proceeds by observation interview test using learning sheets and etc The purpose is to explore students' terms of scientific concepts sources of terms connections between students' usage nomenclature and chooses of usage The results of the research are as follows: 1 There are five kinds of naming principles for students' terms of scientific concepts: appearance habit function replacing and sound Appearance principle contains three categories: color shape and partial construction; habit principle contains custom and ability; replacing principle contains reality and non-reality 2 Students' terms of scientific concepts come from two ways: self-acquisition and learning through senses The former way is only a bit more common than the latter 3 There are three different relationships between students' usage of terms and nomenclature: one both the same in usage and meaning; the other both different; another different usage but the same meaning Normally terms that students used are various from nomenclature in the aspects of usage and meaning only a few would match and even rare for "Synonyms" to occur 4 Alternative options for students' scientific terms are maintenance adaptation or co-existence with formal scientific terms The most common way of selecting usage of terms is to maintain Sometimes students would adapt themselves once learn of scientist's term However some believe that very odd chances for both could exist at the same time
这样的疑问深深引起研究者的好奇,著手探索学生科学概念所使用的语言。本研究透过观察、访谈、学习单施测等方法来进行,目的在探讨学童在科学概念上所使用之学生惯用语、学生惯用语来源、学生惯用语与科学家用语之关联性、学生惯用语选择。研究结果如下:一、学童在科学概念上所使用之学生惯用语的命名原则有五种:外型、习性、功能、藉代称呼及声音,其中外型原则有颜色、体型及部份构造三类目,习性原则有习惯及能力两类目,藉代称呼原则有实体及虚拟两类目。二、学童在科学概念上所使用之学生惯用语有两种来源,分别为自己称取和听来。学生惯用语来源较多为自己称取,透过其他方式听来少一点,但两种来源的比率差距甚小。三、学童在科学概念上所使用之学生惯用语和科学家用语的关系有三种,分别为用语意涵均相同、用语不同意涵相同和用语意涵均不同。学生惯用语通常和科学家的用语是不同的,且其意涵也不同,只有部份学生惯用语和科学家用语意涵均相同,至於学生惯用语和科学家用语不同但意涵相同的极少。四、学童的科学概念相关学生惯用语选择有三种,分别为维持学生惯用语、改变成科学家用语和科学家与学生惯用语皆可。学童的科学概念相关学生惯用语选择,以维持学生惯用语最多,而有些时候学生会在得知科学家的用语后改变成科学家用语,但认为科学家用语和自己使用的学生惯用语皆可的则很少。
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Operation: The performer puts the thumb, forefinger and middle finger on muscles of both sides "Ji Tu" point to rub repeatedly up and down for six times, then attacking and hooking up with forefingers and middle fingers on "feng chi" and "feng fu" points meanwhile "Wan Gu" point, then holding the Back of head with both four finger left, with strength from both hands at the same time and pulling to the bosom, then slowly sending back .
操作:施术者一手拇指与食指,中指分别置于颈部棘突两侧的颈肌部位,由上至下反复操作揉捏至三十六次。然后,再用双手食指,中指分别勾点住&风池&&风府&穴,同时向怀中用力牵拉,然后,再用双手中指勾点住&完骨&穴,其余两手四指抱住受术者后脑处,双手同时用力,向术者怀中牵拉,然后缓慢收手回送。
- 相关中文对照歌词
- Waves And The Both Of Us
- But When The Little Fellow Came Close And Put Both Arms Around His Mother, And Kissed Her In An Appealing Boyish Fashion, She Was Moved To Tenderness
- You And I Both
- You And I Both
- 推荐网络例句
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The split between the two groups can hardly be papered over.
这两个团体间的分歧难以掩饰。
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This approach not only encourages a greater number of responses, but minimizes the likelihood of stale groupthink.
这种做法不仅鼓励了更多的反应,而且减少跟风的可能性。
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The new PS20 solar power tower collected sunlight through mirrors known as "heliostats" to produce steam that is converted into electricity by a turbine in Sanlucar la Mayor, Spain, Wednesday.
聚光:照片上是建在西班牙桑路卡拉马尤城的一座新型PS20塔式太阳能电站。被称为&日光反射装置&的镜子将太阳光反射到主塔,然后用聚集的热量产生蒸汽进而通过涡轮机转化为电力