𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Vibronic dynamics in the low-lying coupled electronic states of methyl cyanide radical cation

✍ Scribed by S. Ghanta; S. Mahapatra

Book ID
108088994
Publisher
Elsevier Science
Year
2008
Tongue
English
Weight
560 KB
Volume
347
Category
Article
ISSN
0301-0104

No coin nor oath required. For personal study only.

πŸ“œ SIMILAR VOLUMES

Extensive theoretical study on the low-l
Extensive theoretical study on the low-lying electronic states of silicon monofluoride cation including spin-orbit coupling
✍ Kun Liu; Wensheng Bian πŸ“‚ Article πŸ“… 2007 πŸ› John Wiley and Sons 🌐 English βš– 190 KB

## Abstract __Ab initio__ calculations on the low‐lying electronic states of SiF^+^ are performed using the internally contracted multireference configuration interaction method with the Davidson correction and entirely uncontracted aug‐cc‐pV5Z basis set. The effects of spin‐orbit coupling are acco

AB initio calculations of the dipole mom
AB initio calculations of the dipole moments in low-lying electronic states of the ccn radical
✍ Koichi Yamashita; Keiji Morokuma πŸ“‚ Article πŸ“… 1987 πŸ› Elsevier Science 🌐 English βš– 297 KB

The structures and dipole moments of the four low-lying electronic states (X 211, A \*A, B 'C -and C \*Z ' ) of the linear CCN radical are investigated by ab initio calculations at SDCIlDZP and TZP levels. For all the electronically excited states, the dipole moments are calculated to be z 3.0 D. Ho