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Table A.1
Radial parameters (in cm-1) adopted for the calculations in Kr iv.
| Configuration | Parameter | HFR | Fitted | Ratio | Notea |
|
|
|||||
| Even parity | |||||
| 4p3 | E av | 31 247 | 30 541 | ||
| F2(4p, 4p) | 63 340 | 56 159 | 0.887 | ||
| α | 0 | −151 | |||
| ζ 4p | 4216 | 4645 | 1.102 | ||
| 4p25p | E av | 263 829 | 253 120 | ||
| F2(4p, 4p) | 65 722 | 52 042 | 0.792 | ||
| α | 0 | −131 | |||
| ζ 4p | 4599 | 4674 | 1.016 | ||
| ζ 5p | 933 | 1116 | 1.196 | ||
| F2(4p, 5p) | 18 258 | 15 003 | 0.822 | ||
| G0(4p, 5p) | 4385 | 3446 | 0.786 | ||
| G2(4p, 5p) | 5522 | 3270 | 0.592 | ||
| Odd parity | |||||
| 4s4p4 | E av | 170 290 | 161 670 | ||
| F2(4p, 4p) | 63 371 | 55 784 | 0.880 | ||
| α | 0 | 44 | |||
| ζ 4p | 4226 | 4517 | 1.069 | ||
| G1(4s, 4p) | 85 304 | 70 258 | 0.824 | ||
| 4p24d | E av | 209 261 | 200 718 | ||
| F2(4p, 4p) | 64 336 | 59 065 | 0.918 | ||
| α | 0 | −901 | |||
| ζ 4p | 4393 | 4761 | 1.084 | ||
| ζ 4d | 212 | 212 | 1.000 | F | |
| F2(4p, 4d) | 47 236 | 37 274 | 0.789 | ||
| G1(4p, 4d) | 56 206 | 44 834 | 0.798 | ||
| G3(4p, 4d) | 34 521 | 26 906 | 0.779 | ||
| 4p25d | E av | 316 350 | 305 188 | ||
| F2(4p, 4p) | 65 754 | 59 179 | 0.900 | F | |
| α | 0 | 0 | F | ||
| ζ 4p | 4592 | 4822 | 1.050 | ||
| ζ 5d | 71 | 71 | 1.000 | F | |
| F2(4p, 5d) | 13 113 | 9803 | 0.748 | ||
| G1(4p, 5d) | 9555 | 5756 | 0.602 | ||
| G3(4p, 5d) | 6550 | 2767 | 0.422 | ||
| 4p25s | E av | 226 731 | 219 299 | ||
| F2(4p, 4p) | 65 231 | 56 784 | 0.871 | ||
| α | 0 | 0 | F | ||
| ζ 4p | 4540 | 3540 | 0.780 | ||
| G1(4p, 5s) | 6715 | 4864 | 0.724 | ||
| 4p26s | E av | 320 594 | 308 931 | ||
| F2(4p, 4p) | 74 046 | 51 830 | 0.700 | ||
| α | 0 | 0 | F | ||
| ζ 4p | 4609 | 4377 | 0.950 | ||
| G1(4p, 6s) | 2039 | 1454 | 0.713 | ||
| 4s4p4–4p24d | R1(4p4p; 4s4d) | 67 039 | 53 177 | 0.793 | |
| 4p24d–4p25s | R2(4p4d; 4p5s) | −11 024 | −8360 | 0.758 | R |
| R1(4p4d; 4p5s) | −3424 | −2597 | 0.758 | R | |
| 4p24d–4p26s | R2(4p4d; 4p6s) | −5593 | −5034 | 0.900 | F |
| R1(4p4d; 4p6s) | −2444 | −2199 | 0.900 | F | |
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