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Author(s):   Wang, M.H.;Sun, X.M.;Bian, W.S.;Cai, Z.T.
Title:   A global 12-dimensional ab initio potential energy surface and dynamical studies for the SiH4 + H → SiH3 + H2 reaction
Journal:   J. Chem. Phys.
Volume:   124
Page(s):  
Year:   2006
Reference type:   Journal article
Squib:   2006WAN/SUN234311

Reaction:   SiH4 + H2 + SiH3
Reaction order:   2
Rate expression:   no rate data available
Category:  Theory
Data type:   Transition state theory
Comments:   A global, 12-dimensional, potential energy surface constructed at the QCISD//cc-pVTZ level of theory. This was used in a variational transition-state theory calculation under POLYRATE to calculate rate constants from 290 to 660 K. Rate constants are only presented graphically and were slightly below experimental results.

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