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[会议论文] 作者:Yanxiao Liu,Wanjian.Ding,Dongqi Wang, 来源:The 15th ICQC International Congress of Quantum Chemistry(第1 年份:2015
[会议论文] 作者:Wanjian.Ding,Yanxiao Liu,Dongqi Wang, 来源:The 15th ICQC International Congress of Quantum Chemistry(第1 年份:2015
The mechanisms of CO2 functionalization promoted by a silylamido N-heterocyclic carbene(NHC) uranium complex M(LD)N″2,where M = U/Ce,LD = OCMe2CH2(1-C{NCH2CH2N-R}),R = 2,6-iPr2-C6H3(abbreviated as Dip...
[会议论文] 作者:Wanjian Ding,Dongqi Wang,Yanxiao Liu, 来源:第十二届全国量子化学会议 年份:2014
The mechanisms of CO2 insertion into the U(Ⅲ)-N bond of M(LD)N”2(LD=2,6-iPr2-C6H3,N”=N(SiMe3)2)were investigated employing Gaussian09 package with B3PW91 functional of density functional theory.The re...
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