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Table 2
Theoretical and experimental energies (Kramida et al. 2015) (in eV) for the terms of target states of O4+ and O5+ relative to the ground state in the calculations of PI of O3+ and O4+.
| O4+ | O5+ | ||||||
|
|
|
||||||
| No. | State | This work | Expt. | State | This work | Expt. | |
|
|
|||||||
| 1 |
1s22s2
|
0.0 | 0.0 |
1s22s
|
0.0 | 0.0 | |
| 2 | 1s22s2p 3P◦ | 10.147 | 10.196 | 1s22p 2P◦ | 12.091 | 11.993 | |
| 3 | 1s22s2p 1P◦ | 19.761 | 19.688 |
1s23s
|
79.283 | 79.355 | |
| 4 |
1s22p2
|
26.449 | 26.502 | 1s23p 2P◦ | 82.556 | 82.503 | |
| 5 |
1s22p2
|
28.739 | 28.730 |
1s23d
|
83.507 | 83.647 | |
| 6 |
1s22p2
|
35.799 | 35.696 |
1s24s
|
105.64 | 105.72 | |
| 7 |
1s22s3s
|
67.688 | 67.816 | 1s24p 2P◦ | 106.97 | 107.05 | |
| 8 |
1s22s3s
|
69.477 | 69.589 |
1s24d
|
107.40 | 107.48 | |
| 9 | 1s22s3p 1P◦ | 71.865 | 72.013 | 1s24f 2F◦ | 107.42 | 107.50 | |
| 10 | 1s22s3p 3P◦ | 72.173 | 72.268 |
1s2s2
|
551.10 | ||
| 11 |
1s22s3d
|
74.460 | 74.486 | 1s2s(3S)2p 4P◦ | 554.76 | 554.24 | |
| 12 |
1s22s3d
|
75.973 | 75.955 | 1s2s(3S)2p 2P◦ | 562.99 | 562.59 | |
| 13 | 1s2s22p 3P◦ | 549.94 |
1s2p2
|
567.81 | 567.23 | ||
| 14 |
1s2s(3S)2p2(3P)
|
552.16 | 1s2s(1S)2p 2P◦ | 568.88 | 568.21 | ||
| 15 | 1s2s22p 1P◦ | 554.80 |
1s2p2
|
573.37 | 572.50 | ||
| 16 |
1s2s(3S)2p2(1D)
|
562.62 |
1s2p2
|
576.21 | 575.76 | ||
| 17 | 1s2s(1S)2p2(3P) | 562.76 |
1s2p2
|
582.83 | 582.30 | ||
| 18 |
1s2s(3S)2p2(1S)
|
568.26 | |||||
| 19 |
1s2s(1S)2p2(1D)
|
569.33 | |||||
| 20 | 1s2s(1S)2p2(3P) | 570.48 | |||||
| 21 |
1s2s(1S)2p2(1S)
|
575.00 | |||||
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