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An Ab Initio Study of the Vibronic Structure in the a 1 Δ g Electronic State of C 2 H 2++

✍ Scribed by Perić, M.; Palaudoux, J.; Hochlaf, M.


Book ID
126093456
Publisher
American Chemical Society
Year
2008
Tongue
English
Weight
214 KB
Volume
112
Category
Article
ISSN
1089-5639

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An AB initio study of the electronic str
✍ Nelson H.F. Beebe; John R. Sabin 📂 Article 📅 1974 🏛 Elsevier Science 🌐 English ⚖ 492 KB

An ab initio LCGO MO SCF calculation using the Roothaan open-shell procedure was carried out on C202. The electronic structure and stability of the molecule is discussed.