| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 5394261 | Computational and Theoretical Chemistry | 2012 | 5 Pages |
Abstract
⺠Theoretical study for the spin-forbidden reaction of NO2 and CO catalyzed by Ir+. ⺠Reactions are typical “two-state reactivity” (TSR) reactions, two crossing points (CP1 and CP2) are involved. ⺠Because of the large SOC involved, the ISC occur effectively. ⺠The energetic span (δE) model was applied in this cycle to obtain some kinetic information.
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Physical and Theoretical Chemistry
Authors
Jian-Hui Zhang, Yong-Cheng Wang, Yan-Li Leng,