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Theoretical studies on the structures and isomerization of the LiSiF3system

✍ Scribed by Dacheng Feng; Qijun Lin; Shengyu Feng; Wencai Lü

Publisher
SP Science China Press
Year
1999
Tongue
English
Weight
359 KB
Volume
42
Category
Article
ISSN
1674-7291

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## Abstract The structures and isomerization of silylenoid (Tsi)Cl~2~SiLi (Tsi = C(SiMe~3~)~3~) were studied by density functional theory (DFT) at the B3LYP/6‐31G(d) level. Four equilibrium structures and three isomeric transition states were located. The three‐membered ring and __p__‐complex struc