Table A.5
Comparison between available experimental values of the first few excited energy levels in Os I–IV and the HFR results obtained without scaling down the Slater integrals (SF = 1.00) and with a scaling factor of 0.85 (SF = 0.85).
| Configuration | J | EExp (cm−1)a | EHFR (cm−1)b | ΔE (cm−1)c | ||
|---|---|---|---|---|---|---|
| SF = 1.00 | SF = 0.85 | SF = 1.00 | SF = 0.85 | |||
| Os I | ||||||
| 5d66s2 | 4 | 0.00 | 0 | 0 | 0 | 0 |
| 5d66s2 | 2 | 2740.49 | 3834 | 3269 | 1094 | 529 |
| 5d66s2 | 3 | 4159.32 | 4468 | 4663 | 309 | 504 |
| 5d76s | 5 | 5143.92 | 5940 | 4927 | 796 | -217 |
| 5d66s2 | 1 | 5766.14 | 6623 | 6594 | 857 | 828 |
| 5d66s2 | 0 | 6092.79 | 7120 | 6975 | 1027 | 882 |
| 5d76s | 4 | 8742.83 | 9757 | 8656 | 1014 | -87 |
| 5d76s | 2 | 10165.98 | 11879 | 11146 | 1713 | 980 |
| 5d76s | 4 | 11030.58 | 13156 | 11586 | 2125 | 555 |
| 5d76s | 3 | 11378.00 | 12850 | 11787 | 1472 | 409 |
| 5d76s | 2 | 12774.38 | 14557 | 13356 | 1783 | 582 |
| ... | ... | ... | ... | ... | ... | ... |
| Os II | ||||||
| 5d66s | 9/2 | 0.00 | 0 | 0 | 0 | 0 |
| 5d66s | 7/2 | 3593.15 | 3773 | 3871 | 180 | 278 |
| 5d66s | 5/2 | 3928.94 | 4598 | 4372 | 669 | 443 |
| 5d66s | 3/2 | 5592.05 | 6290 | 6089 | 698 | 497 |
| 5d66s | 1/2 | 6636.57 | 7292 | 7238 | 655 | 600 |
| 5d66s | 5/2 | 7891.93 | 7890 | 8941 | -2 | 1049 |
| 5d66s | 7/2 | 11459.90 | 13103 | 11640 | 1643 | 180 |
| 5d66s | 5/2 | 11654.08 | 12671 | 12486 | 1017 | 832 |
| 5d66s | 3/2 | 13136.61 | 13448 | 11373 | 311 | -1764 |
| 5d66s | 7/2 | 13203.88 | 15206 | 13260 | 2002 | 56 |
| 5d66s | 5/2 | 13414.80 | 15296 | 14081 | 1881 | 666 |
| ... | ... | ... | ... | ... | ... | ... |
| Os III | ||||||
| 5d6 | 4 | 0.00 | 0 | 0 | 0 | 0 |
| 5d6 | 3 | 3849.26 | 2119 | 4533 | -1730 | 684 |
| 5d6 | 2 | 3993.38 | 4728 | 4395 | 735 | 402 |
| 5d56s | 3 | 4578.41 | 4404 | 5838 | -174 | 1260 |
| 5d6 | 1 | 6154.41 | 6838 | 6931 | 684 | 777 |
| 5d6 | 0 | 6316.98 | 7144 | 7069 | 827 | 752 |
| 5d6 | 4 | 12535.51 | 15120 | 12899 | 2584 | 363 |
| 5d6 | 2 | 15131.09 | 17398 | 16033 | 2267 | 902 |
| 5d6 | 5 | 15780.66 | 18650 | 16392 | 2869 | 611 |
| 5d6 | 6 | 16720.70 | 19582 | 17140 | 2861 | 419 |
| 5d6 | 3 | 17073.05 | 20200 | 18091 | 3127 | 1018 |
| ... | ... | ... | ... | ... | ... | ... |
| Os IV | ||||||
| 5d5 | 5/2 | 0.00 | 0 | 0 | 0 | 0 |
| 5d5 | 5/2 | 15617.70 | 19743 | 15780 | 4126 | 162 |
| 5d5 | 7/2 | 19886.30 | 24106 | 20463 | 4220 | 577 |
| 5d5 | 3/2 | 20218.30 | 24467 | 20805 | 4249 | 587 |
| 5d5 | 5/2 | 20944.70 | 25035 | 21665 | 4090 | 720 |
| 5d5 | 11/2 | 21105.10 | 25168 | 21573 | 4063 | 468 |
| 5d5 | 9/2 | 21764.60 | 25898 | 22430 | 4133 | 665 |
| 5d5 | 1/2 | 22521.80 | 26780 | 23231 | 4258 | 709 |
| 5d5 | 7/2 | 25587.80 | 30351 | 26666 | 4763 | 1078 |
| 5d5 | 5/2 | 27067.50 | 32098 | 27962 | 5030 | 894 |
| 5d5 | 1/2 | 28517.70 | 33396 | 29848 | 4878 | 1330 |
| ... | ... | ... | ... | ... | ... | ... |
Notes. a Experimental energy levels from Kramida et al. (2023) for Os I–III and from Ryabtsev et al. (1998) for Os IV.(b) This work.(c) ΔE = EHFR − EExp.
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