查询词典 relative stability
- 与 relative stability 相关的网络例句 [注:此内容来源于网络,仅供参考]
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Combination fixation refers to the use of both absolute and relative stability principles on the same fracture/bone.
结合固定是指在同一骨折同时应用绝对和相对稳定原则固定。
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Due to relative stability of 'biological clock", one passing several time zones over median, inner biological clock will be out of step with environmental time, which is called "Jetlag.
由于"生物钟"的相对稳定性,跨子午线快速跨越若干个时区飞行,即可造成体内的"生物钟"与环境时间失去同步关系,称为"时差"。
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Moreover, the Pareto optimum vector of benefit distribution, which can impel the alliance system to operate more smoothly, is computed. And also a new notion of "Dynamic Relative Stability" and an approach of solving the problem of the optimum stability of NESA under the effective organizational restriction are proposed.
其中,论文研究得到了促使整个联盟系统平衡运转的帕累托最优利益分配向量,提出了"动态相对稳定"的概念,解决了如何在有效的联盟组织约束下达到最优的稳定性水平的问题。
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The structural parameters of PNHAAs, such as the the maximum N-NO2 bond length, the least N-N Mulliken population, the least negative charge on the nitro group (QNO2) and OB100, were studied to predict their relative stability or sensitivity (the easiness for initiating a detonation, high sensitivity means low stability).
通过研究PNHAAs的结构参数,如N-NO2最大键长、N-NO2键的最小Mulliken集居数、-NO2所带最小负电荷、氧平衡,预测了10个标题物的相对稳定性或感度(起爆的难易程度。感度越高,化合物的稳定性越低)。
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The stability energy of the whole complex, and the interaction energy between two purine bases and the [Pt-(NH3)thiazole]2+ group were adopted to study the interplay among subsystems and their contribution to relative stability of all the studied cross-link model.
本文采用化合物整体稳定化能,两个嘌呤碱基与[Pt-(NH3)thiazole]2+部分的相互作用能来研究不同部分间的相互作用及其对加合物的相对稳定性的影响。
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In this thesis,the AM1,MNDO,MINDO/3(mainly AM1)and INDO/S-CI semiempirical MO methods were used toinvestigate the excited-state intramolecular protontransfer reactions of salicylic acid derivatives—salicylic acid,methyl salicylate,salicylaldehyde,o-hydroxyaceto-phenone,salicylamide and 3-hydroxy-picolinamide (6 conformers and 2-3 anion species);2-(2'-hydroxy-5' methylphenyl) benzotriazole(4 conformers),2-(2' hydroxyphenyl) benzimidazole (3 conformers and 3anion species),Bis-2,5-(2-benzoxazolyl)hydroquinone(3 conformers),2-(2'-hydroxyphenyl)benzothiazole(2conformers) and 7-azaindole dimer (2 conformers).Theinvestigations were described as follows.Geometry optimization,relative stability andhydrogen bonding energy First,for sylicylic acid derivative molecules,the AM1,MNDO and MINDO/3 methods were used toinvestigate ground-state geometry optimization,energies,relative stabilities and hydrogen-bondingenergies on the five kinds of the molecules(designing 6 conformers and 2-3 anion species).Comparing with experimental data,the optimizedgeometry,the order of stability,the hydrogen-bonding energies and the distances between O-O in O-H..O hydrogen bonds by AM1 method were in agreementwith the experimental data,however,the C-C bondlengths optimized by MNDO and MINDO/3 were longer,C-O and O-H bond lengths were shorter;for C-N bondlengths,the results opitimized by MNDO method werethe same as those by AM1 method,nevertheless the C-Nbond lengths given by MINDO/3 method were muchshorter.For some sylicylic acid derivatives(e.g.methyl salicylate,salicylamide),the order ofstabilities on the conformers given by MNDO andMINDO/3 methods were not in agreement with theexisting conformers deduced by experimental methods,and the hydrogen bonding energies calculated by MNDO.and MINDO/3 methods were smaller.Second,the studyon the other systems found that the optimizedgeometry of the proton-transfered product with INDOmethod could not be obtained,only could theoptimized geometry of reactant be obtained,and thecalculated hydrogen bonding energies were greater.Many results of calculation indicated that the studyon the excited-state intramolecular proton transferreaction system using AM1 method was suitable andreliable.
本论文用AM1、MNDO、MINDO/3(主要是AM1)和INDO/S-CI半经验分子轨道方法对水杨酸衍生物系列——水杨酸、水杨酸甲酯、水杨醛、O-羟基乙酰苯酮、水杨酰胺和3-羟基吡啶酰胺(6种异构体和2-3种阴离子);2-(2'-羟基-5'-甲基苯基)苯并三〓唑(4种异构体);2-(2'-羟基苯基)苯并咪唑(3种异构体和3种阴离子);2,5-二间氮杂氧茚氢醌(3种异构体);2-(2'-羟基苯基)间〓杂硫茚(2种异构体)和7-〓吲哚二体(2种异构体)的激发态分子内质子转移反应在以下几个方面进行了较系统的理论研究:几何构型优化和相对稳定性及氢键能首先以水杨酸衍生物系列分子为例,用AM1、MNDO和MINDO/3方法考察了5种分子(每种分子设计6种异构体和2-3种阴离子)的基态几何构型优化,能量、相对稳定性和氢键能计算,通过和实验数据进行比较,AM1方法给出的优化几何构型、稳定性次序、氢键能和O—H。。。O氢键的0—0距离与实验数据吻合最好,MNDO和MINDO/3方法优化的C-C键长偏长,C-O键和O-H键长偏短;对于C-N键长,MNDO和AM1优化结果差别不大,而MINDO/3给出了过短的C-N键长,MNDO和MINDO/3方法给出的有些水杨酸衍生物分子(如水杨酸甲酯和水杨酰胺)异构体的稳定性次序和实验上推测的可存在异构体结果不一致,MNDO和MINDO/3方法给出的氢键能偏低,对其他体系的研究发现INDO方法常常不能得到质子转移产物的优化几何构型,只能得到反应物的优化构型,并且估算的氢键能偏高,大量的计算结果表明AM1方法对本论文研究的激发态分子内质子转移反应体系是适宜和可靠的。
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Grasp the electron delocolization theory; be capable of judging the relative stability of allylic and benzylic free radicals and carbocations, know the relative stability of dienes and other multiple unsaturated hydrocarbons; grasp the characteristics for the nucleophilic substitution reactions of allyl halides and benzyl halides, and the addition reactions of conjugate dienes.
掌握电子非定域化理论;能够分析判断烯丙基、苄基自由基和正离子的稳定性和二烯及多重不饱和碳氢化合物的稳定性;掌握烯丙基、苄基卤代物的亲核取代反应特性和共轭二烯的加成反应。
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The order of relative stability of the PCPX congeners was theoretically proposed based on the relative magnitude of their Δf .
根据异构体标准生成自由能的相对大小,从理论上求得异构体的相对稳定性。
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A new Criterion-the maximum energy ratio criterion was suggested to evalate the relative stability of rotor bearing systems. The contribution of each bearing to system stability was investigated.
由于几种常用的评估系统稳定性好坏的判据存在某些不足,促使作者对这一问题进行了探索性的研究,提出了以最大能量比率作为衡量系统稳定性好坏的判据。
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Density functional theory calculations were performed to study the structures and relative stability of the gadolinium complexes, Gd(H2O)n3+(n=8,9), in vacuo and in aqueous solution. The polarizable continuum model with various radii for the solute cavity was used to study the relative stability in aqueous solution.
用密度泛函理论方法研究了气相和水溶液中Gd(H2O)n3+(n=8,9)化合物的结构和相对稳定性,其中水溶剂效应利用极化连续介质方法结合多种溶质空腔模型进行模拟。
- 推荐网络例句
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This one mode pays close attention to network credence foundation of the businessman very much.
这一模式非常关注商人的网络信用基础。
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Cell morphology of bacterial ghost of Pasteurella multocida was observed by scanning electron microscopy and inactivation ratio was estimated by CFU analysi.
扫描电镜观察多杀性巴氏杆菌细菌幽灵和菌落形成单位评价遗传灭活率。
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There is no differences of cell proliferation vitality between labeled and unlabeled NSCs.
双标记神经干细胞的增殖、分化活力与未标记神经干细胞相比无改变。