The QED-MP2 model based on the quasi-energy derivative method in the second-order Moller-Plesset perturbation theory is formulated, and frequency-dependent (dynamic) polarizabilities [a(-w; o~)] for H20 and NH3 are calculated. Dynamic polarizabilities obtained for HzO agree with experimental values.
✦ LIBER ✦
Calculation of frequency-dependent first hyperpolarizabilities using the second-order Møller–Plesset perturbation theory
✍ Scribed by Kobayashi, Takao; Sasagane, Kotoku; Aiga, Fumihiko; Yamaguchi, Kizashi
- Book ID
- 120182751
- Publisher
- American Institute of Physics
- Year
- 1999
- Tongue
- English
- Weight
- 516 KB
- Volume
- 110
- Category
- Article
- ISSN
- 0021-9606
- DOI
- 10.1063/1.479171
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