## 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
Ci calculations of the low lying electronic states of the radical SiH3, SiH+3 and SiH−3
✍ Scribed by Bernd Wirsam
- Publisher
- Elsevier Science
- Year
- 1973
- Tongue
- English
- Weight
- 266 KB
- Volume
- 18
- Category
- Article
- ISSN
- 0009-2614
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## 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
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