The doublet potential energy surface related to the reaction between PH + and H 2 O is investigated at the B3LYP/6-311G(d), CCSD(T)/6-311+G(2df,2pd) (single-point), MP2/6-311+G(2d,p), and G3B3 levels. A total of four products are generated via two entrances and H 2 O molecule can be attacked by eith
A theoretical study on the reaction of C3H+ with H2O
✍ Scribed by Z.-W. Qu; Y.-H. Ding; Z.-S. Li; C.-C. Sun
- Book ID
- 114143580
- Publisher
- Elsevier Science
- Year
- 1999
- Tongue
- English
- Weight
- 289 KB
- Volume
- 489
- Category
- Article
- ISSN
- 0166-1280
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