A theoretical study of the hydrogen molecule activation by the Ni2 cluster, nickel phthalocyanine and a complex formed by nickel phthalocyanine with the Ni2 cluster

被引:0
|
作者
Mamaev, VM [1 ]
Ermakov, KV [1 ]
Gloriozov, IP [1 ]
Gradoboev, MN [1 ]
Ishchenko, SY [1 ]
Lemenovskii, DA [1 ]
机构
[1] Moscow MV Lomonosov State Univ, Dept Chem, Moscow 119899, Russia
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中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
A new system based on the addition of the Ni-2 Cluster to a mononuclear phthalocyanine complex with an energy stability of about 26 kcal mol(-l) was suggested for the barrierless activation of the H-H bond.
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页码:190 / 192
页数:3
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