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dc.contributor.advisor谭凯
dc.contributor.advisor吕鑫
dc.contributor.author尹凡华
dc.date.accessioned2018-12-05T01:10:59Z
dc.date.available2018-12-05T01:10:59Z
dc.date.issued2018-02-26
dc.identifier.urihttps://dspace.xmu.edu.cn/handle/2288/168324
dc.description.abstract由于具有特殊的几何结构和物理化学性质,富勒烯及其外部衍生物自C60(Ih)发现以来就引起人们的广泛研究。目前,实验上合成和分离的富勒烯外部衍生物以卤化富勒烯为主,特别是富勒烯氯化物。通常,有两种形成富勒烯氯化物的反应途径:第一种途径是石墨在电弧放电的同时引入氯源(CCl4);第二种途径是将电弧放电产生的碳灰与氯化试剂如VCl4和SbCl5在低温下反应,从而形成富勒烯氯化物。在第二种途径中首先合成的母笼被认为是热力学上有利的,但是一些通过第二种途径分离的富勒烯氯化物的母笼在热力学上是不利的。这些富勒烯氯化物的形成机理尚不清楚。因此,理论研究这些富勒烯氯化物及其形成机理对理解和帮助设计新的富勒烯材...
dc.description.abstractBecause of the special geometric structure,chemical and physical properties, fullerenes and their exohedral derivatives have been widely investigated since the discovery of Ih-symmetric C60. At present, experimental synthesis and separation of the exohedral derivatives are mostly halogenated fullerenes, especially fullerene chlorides. Generally, there are two reaction pathways for the formation of...
dc.language.isozh_CN
dc.relation.urihttp://210.34.4.28/opac/openlink.php?strText=59350&doctype=ALL&strSearchType=callno
dc.source.urihttp://etd.xmu.edu.cn/detail.asp?serial=60677
dc.subject富勒烯
dc.subject富勒烯氯化物
dc.subject密度泛函理论
dc.subject动力学稳定性
dc.subject形成机理
dc.subjectFullerene
dc.subjectFullerene Chlorides
dc.subjectDensity Functional Theory
dc.subjectKinetic Stability
dc.subjectFormation Mechanism
dc.title动力学稳定性对富勒烯及其衍生物形成的影响的理论研究
dc.title.alternativeTheoretical Investigation on the Effect of the Kinetic Stability on the Formation of Fullerenes and Their Derivates
dc.typethesis
dc.date.replied2017-05-22
dc.description.note学位:理学硕士
dc.description.note院系专业:化学化工学院_物理化学
dc.description.note学号:20520141151609


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