Theoretical investigation of uranium（IV） coordinated with N, N ′- bis（3-allyl salicylidene）-o-pheny

来源 :核技术：英文版 | 被引量 : 0次 | 上传用户：sadddddd

【摘要】

：

We used density functional theory calculations at the B3LYP/6-311G** level for a theoretical study on the complex formed when uranium(Ⅳ) coordinates with N,N&#

【作者】

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Wen-Bo Lan Sha Gao Ying-Wu Lin

【机构】

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SchoolofChemistryandChemicalEngineering

【出处】

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核技术：英文版

【发表日期】

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2016年5期

【关键词】

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邻苯二胺烯醛调理位错结构铀热力学性质密度函数电荷分布 Density funct ional theory - N N′- bis（3-ally

【基金项目】

：

AcknowledgmentsThis work is supported by National NaturalScience Foundation of China （No： 11275090, 51574152）, HunanProvincial Natural Science Foundation for Distinguished YoungScholars （2015JJ1012） a

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We used density functional theory calculations at the B3LYP/6-311G** level for a theoretical study on the complex formed when uranium(Ⅳ) coordinates with N,N'- bis(3-allyl salicylidene)-o-phenylenediamine(BASPDA),i.e.,U(BASPDA)_2.The results indicated

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Theoretical investigation of uranium（IV） coordinated with N, N ′- bis（3-allyl salicylidene）-o-pheny

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