## Abstract Coupled‐cluster calculations are used to compute the energy of conversion between the neutral and the zwitterionic forms of β‐carboline. The stability of the different species is discussed in terms of charge separation and aromatic character, which is related to magnetic criteria. By me
Microwave Spectroscopic Study of NiF in the Electronic Ground and Lowest Excited States
✍ Scribed by Mitsutoshi Tanimoto; Toru Sakamaki; Toshiaki Okabayashi
- Publisher
- Elsevier Science
- Year
- 2001
- Tongue
- English
- Weight
- 77 KB
- Volume
- 207
- Category
- Article
- ISSN
- 0022-2852
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✦ Synopsis
The rotational spectra of NiF in the electronic ground 2 state and the lowest electronically excited 2 state have been observed. The source of nickel atom was sputtering from a nickel electrode or nickel powder placed on a stainless steel electrode. The molecular constants have been determined by a least-squares analysis of the observed transition frequencies. The rapid increase in the -type splittings in the ground state reveals that the observed rotational transitions are ascribed to the spin substate 2 3/2 . The rotational transitions corresponding to the other substate, 2 1/2 , have not been observed. The large spin-rotation interaction constant γ in the electronically excited 2 state is consistent with that from the electronic spectroscopy.
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