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Density functional theory of CH bond activation by transition-metal complex: A (η5-C5H5)ML (M=Rh, Ir; L=CH2, CO, SH2, PH3)+CH4 case study

✍ Scribed by Ming-Der Su; San-Yan Chu


Publisher
John Wiley and Sons
Year
1999
Tongue
English
Weight
176 KB
Volume
72
Category
Article
ISSN
0020-7608

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✦ Synopsis


B3LYPrLANL2DZ calculations suggested that the singlet᎐triplet Ž .