Ab initio SCF and CI calculations are reported for excitetion energies, oscillator strengths and geometry of , upper states in the low-energy electronic transitions of water. Good agreement is obtained with experimental data where available, both with regard to the location and intensity of the mric
โฆ LIBER โฆ
Non-empirical calculations on the electronic spectrum of butadiene
โ Scribed by Shingkuo Shih; Robert J. Buenker; Sigrid D. Peyerimhoff
- Publisher
- Elsevier Science
- Year
- 1972
- Tongue
- English
- Weight
- 713 KB
- Volume
- 16
- Category
- Article
- ISSN
- 0009-2614
No coin nor oath required. For personal study only.
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