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Table 3
Vertical IPs (in eV) for HNO obtained with cc-pVDZ (BS1), cc-pVTZ (BS2), and cc-pVQZ (BS3) basis sets.
| State | BS1 | BS2 | BS3 | Expt |
|---|---|---|---|---|
| X2A′ | 11.09 | 10.96 | 10.95 | 10.10(a) |
| A2A″ | 13.40 | 13.29 | 13.30 | |
| B2A′ | 16.58 | 16.47 | 16.46 | |
| C2A″ | 17.28 | 17.11 | 17.07 |
Notes. (a) From Lias et al. (1988).
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