Ab initio calculations for the excited states of the positive ions of naphthalene, anthracene and phenanthrene have been carried out to elucidate their absorption spectra in the UV-VIS range (200-1000 nm). With restricted open-shel! Hartree-Fock one-particle basis functions employing double-~" or tr
✦ LIBER ✦
Theoretical characterization of the absorption spectra of phenanthrene and its radical cation
✍ Scribed by R. González-Luque; L. Serrano-Andrés; M. Merchán; M. P. Fülscher
- Publisher
- Springer
- Year
- 2003
- Tongue
- English
- Weight
- 282 KB
- Volume
- 110
- Category
- Article
- ISSN
- 1432-2234
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