Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5389020 | Chemical Physics Letters | 2007 | 7 Pages |
Abstract
Theoretical investigations are carried out on the reactions Cl + CH3COCCl2X (X = F, Cl, Br) by means of direct dynamics method at the MC-QCISD//MP2/6-31+G(d,p) level. The rate constants are calculated by CVT with SCT correction in the temperature range 200-3000 K.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Hui Zhang, Gui-ling Zhang, Jing-yao Liu, Miao Sun, Bo Liu, Ze-sheng Li,