Ab initio SCF study of the ethylene + chlorine reaction
โ Scribed by Jaszunski, Michal; Kochanski, Elise
- Book ID
- 126402159
- Publisher
- American Chemical Society
- Year
- 1977
- Tongue
- English
- Weight
- 641 KB
- Volume
- 99
- Category
- Article
- ISSN
- 0002-7863
No coin nor oath required. For personal study only.
๐ SIMILAR VOLUMES
The Thouiess instability conditions of the a&l radical have been investigated at the ab initia level using minimal and extended A0 basis sets. The main source of R~F-instab~ty is found in its pi-orbital system, but there is tendency for the resulting symmetry dilemma to disappear when approaching th
Ab milio SCF and CI calculations usmg a double-zeta plus polarrwr~on bans SIX hdx,s been prrlormed on the chlorms difluoride cation (GIFT ) and the anion (CIF; ) to determine [heir ground-slate electrontc structure The ClF;l ran IF predfcwd lo have a suongly benr (G,) swucmre (bond angle -Leo) and t
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