Full CI calculations are performed for ionized states, electronattached states and triplet excited states of HzO. The calcularions are compared with our recently developed SAC CI results. The trends of the results are found to be encoura\_ging.
β¦ LIBER β¦
CAP/SAC-CI method for calculating resonance states of metastable anions
β Scribed by Masahiro Ehara; Thomas Sommerfeld
- Book ID
- 113555651
- Publisher
- Elsevier Science
- Year
- 2012
- Tongue
- English
- Weight
- 478 KB
- Volume
- 537
- Category
- Article
- ISSN
- 0009-2614
No coin nor oath required. For personal study only.
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