Charge Characteristics of Titanocene Dicarboranyl by the Mulliken Method

被引:0
作者
G. V. Loukova
A. A. Milov
机构
[1] Federal Research Center of Problems of Chemical Physics and Medicinal Chemistry,
[2] Russian Academy of Sciences,undefined
[3] Federal Research Center Southern Scientific Center,undefined
[4] Russian Academy of Sciences,undefined
来源
High Energy Chemistry | 2023年 / 57卷
关键词
titanocene; carboranyl; Mulliken population analysis; ligand-to-metal charge transfer; density functional theory; Hartree–Fock method;
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摘要
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页码:472 / 477
页数:5
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