Title of article
Vibrational mode analysis for the multi-channel reaction of CH3O+CO
Author/Authors
Zhou، نويسنده , , Zhengyu and Cheng، نويسنده , , Xueli and Zhou، نويسنده , , Xinming and Fu، نويسنده , , Hui، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2002
Pages
9
From page
281
To page
289
Abstract
All species involved in the multi-channel reaction of CH3O with CO have been optimized utilizing the Gaussian94 procedure package at the B3LYP/6-311++G** level. The vibrational mode analysis is used to elucidate the relationships of the transition states, intermediate and the products. The extensive investigation shows that the reaction mechanism is reliable.
Journal title
Chemical Physics Letters
Serial Year
2002
Journal title
Chemical Physics Letters
Record number
1779669
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