𝔖 Bobbio Scriptorium
✦   LIBER   ✦

An ab initio study of the reaction of CH2F+ with acetylene

✍ Scribed by R. López; E. del Rı́o; M.I. Menéndez; P. Campomanes; T.L. Sordo


Book ID
114141269
Publisher
Elsevier Science
Year
2001
Tongue
English
Weight
217 KB
Volume
537
Category
Article
ISSN
0166-1280

No coin nor oath required. For personal study only.


📜 SIMILAR VOLUMES


Ab initio study of the formation of C3H3
✍ L�pez, Ram�n; Sordo, Jos� A.; Sordo, Tom�s L.; von Ragu� Schleyer, Paul 📂 Article 📅 1996 🏛 John Wiley and Sons 🌐 English ⚖ 366 KB 👁 2 views

Ab initio molecular orbital theory has been used to study the mechanism of the formation of C,H, ' from the reaction of CH,+ with acetylene. The highest level geometry optimizations and frequencies were computed at MP2-FC/6-31G\* \* ; single point energies of all the critical structures were compute