𝔖 Bobbio Scriptorium
✦   LIBER   ✦

An experimental and theoretical study of the spectroscopic and thermodynamic properties of toluene

✍ Scribed by D.A Shaw; D.M.P Holland; M.A MacDonald; M.A Hayes; L.G Shpinkova; E.E Rennie; C.A.F Johnson; J.E Parker; W von Niessen


Book ID
108430675
Publisher
Elsevier Science
Year
1998
Tongue
English
Weight
467 KB
Volume
230
Category
Article
ISSN
0301-0104

No coin nor oath required. For personal study only.


πŸ“œ SIMILAR VOLUMES


Theoretical study of structure and therm
✍ S. Roszak; K. Balasubramanian πŸ“‚ Article πŸ“… 1995 πŸ› Elsevier Science 🌐 English βš– 429 KB

Ab initio complete active space self-consistent field (CASSCF) followed by configuration interaction computations that included up to 530000 configurations are carried out on YC 2. Dissociation and atomization energies for the theoretically determined structure agree with the experimental studies of