## Abstract The multiple‐channel reactions SiH~3~ + SiH(CH~3~)~3~ → products are investigated by direct dynamics method. The minimum energy path (MEP) is calculated at the MP2/6‐31+G(d,p) level, and energetic information is further refined by the MC‐QCISD (single‐point) method. The rate constants f
Theoretical study of the molecular ions SiH−5 and SiH−3
✍ Scribed by Frerich Keil; Reinhart Ahlrichs
- Publisher
- Elsevier Science
- Year
- 1975
- Tongue
- English
- Weight
- 621 KB
- Volume
- 8
- Category
- Article
- ISSN
- 0301-0104
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## Abstract The multiple‐channel reactions SiH~3~ + SiH~3~CH~3~ → products and SiH~3~ + SiH~2~(CH~3~)~2~ → products are investigated by direct dynamics method. The minimum energy path (MEP) is calculated at the MP2/6‐31+G(d,p) level, and energetic information is further refined by the MC‐QCISD meth
Theoretical investigations are carried out on the multiple-channel reactions, CH 3 þ SiH(CH 3 ) 3 ! products and CF 3 þ SiH(CH 3 ) 3 ! products. The minimum energy paths (MEP) are calculated at the MP2/6-311 þ G(d,p) level, and energetic information is further refined by the MC-QCISD (single point)
I3he molecuIar structures of SiI-&N3 and (Sti3)2NCN have been detern&d by electron diffraction: Sii-I~Ns has a non-lincti SiNs skeleton, and (S~HJ)~NCN is a carbodiimide with SiNCKSi probably linear. A new model is pro-p&d which rationaLises the observed geome!ry of a number of molecu&r pseudohalide