𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Radiative decay of the Ar2+2 excimer: an ab initio study

✍ Scribed by A.V. Zaitsevskii; A.I. Dement'ev


Publisher
Elsevier Science
Year
1991
Tongue
English
Weight
228 KB
Volume
86
Category
Article
ISSN
0030-4018

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


An ab initio study of Si2C protonation
✍ A. Largo-Cabrerizo; J.R. Flores πŸ“‚ Article πŸ“… 1988 πŸ› Elsevier Science 🌐 English βš– 428 KB
An ab initio study of C2S protonation
✍ Carmen Barrientos; Antonio Largo πŸ“‚ Article πŸ“… 1991 πŸ› Elsevier Science 🌐 English βš– 583 KB
An AB initio study of the electronic str
✍ Nelson H.F. Beebe; John R. Sabin πŸ“‚ Article πŸ“… 1974 πŸ› Elsevier Science 🌐 English βš– 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.

An ab initio study of the electron affin
✍ Remedios GonzΓ‘lez-Luque; Manuela MerchΓ‘n; Markus P. FΓΌlscher; BjΓΆrn O. Roos πŸ“‚ Article πŸ“… 1993 πŸ› Elsevier Science 🌐 English βš– 902 KB

Coupled pair functional, multiconfigurational second-order perturbation theory, and multireference CI methods have been applied in a calculation of the electron affinity of the oxygen molecule. The convergence of the theoretical result has been checked with respect to a systematic expansion of the o

Ab initio study of the (COS)+2 complex
✍ Michael L. McKee πŸ“‚ Article πŸ“… 1991 πŸ› Elsevier Science 🌐 English βš– 351 KB

The ion-molecule complex (COS): is predicted to be bound by a 2o3e bond between two sulfur atoms. The lowest energy structure has C1 symmetry with a S-S distance of 2.866 A at the UHF/6-31G\* level. The calculated binding energy at the [PMP4/ 6-31 +G\*] +ZPC level (19.9 kcal/mol) is in good agreemen

An AB initio molecular orbital study of
✍ J.C. Cobb; A. Hinchliffe πŸ“‚ Article πŸ“… 1974 πŸ› Elsevier Science 🌐 English βš– 129 KB

Kcccivud 4 Ocrobcr I97 3 Gaussian orbital calculations 01. the ESR coupling consrunts in the PI-2 radical arc prescnred, in cscellcnt agree mcnt with experiment.