The equilibrium geometries, excitation energies, force constants, and vibrational frequencies of the low-lying electronic states X2B1, 2A1, 2B2, and 2A2 of the PF2 radical have been calculated at the MRSDCI level with a double zeta plus polarization basis set. Our calculated geometry, force constant
β¦ LIBER β¦
Ab initio study of low-lying electronic states of the NF2 radical
β Scribed by Z.-L. Cai; G.-H. Sha; C.-H. Zhang; M.-B. Huang
- Book ID
- 107735123
- Publisher
- Elsevier Science
- Year
- 1991
- Tongue
- English
- Weight
- 463 KB
- Volume
- 178
- Category
- Article
- ISSN
- 0009-2614
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