Photoelectron spectra of anions in solutions and the ionisation energy of the solvated electron
β Scribed by R.E. Ballard; Jimmy Jones; Elizabeth Sutherland; Chun Bae Lee
- Publisher
- Elsevier Science
- Year
- 1983
- Tongue
- English
- Weight
- 268 KB
- Volume
- 97
- Category
- Article
- ISSN
- 0009-2614
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
## Abstract The ionisation energies and the HeI photoelectron spectra of the Nβoxides of diazabenzenes are presented. The valence electronic structures of the Nβoxides are discussed in view of the ionisation energies, and the profiles, of the bands. The interpreted data are compared to calculations
## Abstract The conductorβlike solvation model, as developed in the framework of the polarizable continuum model (PCM), has been reformulated and newly implemented in order to compute energies, geometric structures, harmonic frequencies, and electronic properties in solution for any chemical system
The planar cis conformer is calculated as lowest in energy but the trans is sufficiently close that both species may be present at room temperature. The difference in the peak absorption energy for the strong 1 'A'+2 'A' transition is calculated to be sufflciently large between the conformers to dis