Table 2 Potential energies, bound-state energy eigenvalues and experimental Rydberg–Klein–Rees data for the 7Li2 (2 3Πg) molecule.
From: Bound-state energy spectrum and thermochemical functions of the deformed Schiöberg oscillator
n | r (Å)77 | U (cm-1) | Energy (cm−1) | |||
|---|---|---|---|---|---|---|
rmin | rmax | Umin | Umax | RKR77 | En | |
0 | 3.62168 | 4.07370 | 99.3651 | 89.5434 | 93.8116 | 94.0400 |
1 | 3.46650 | 4.25411 | 295.2991 | 272.2217 | 280.1512 | 281.1230 |
2 | 3.36240 | 4.38449 | 491.2207 | 454.4276 | 464.2410 | 466.5924 |
3 | 3.27941 | 4.49478 | 686.7777 | 635.8801 | 646.1710 | 650.4376 |
4 | 3.20885 | 4.59362 | 881.5848 | 816.4616 | 826.0218 | 832.6477 |
5 | 3.14678 | 4.68493 | 1075.2478 | 996.0476 | 1003.8648 | 1013.2117 |
6 | 3.09100 | 4.77089 | 1267.4681 | 1174.5370 | 1179.7632 | 1192.1182 |
7 | 3.04013 | 4.85285 | 1458.0222 | 1351.8158 | 1353.7728 | 1369.3557 |
8 | 2.99133 | 4.93171 | 1654.6885 | 1527.7589 | 1525.9427 | 1544.9124 |
9 | 2.94974 | 5.00811 | 1833.0904 | 1702.2508 | 1696.3158 | 1718.7760 |
10 | 2.90905 | 5.08253 | 2017.3513 | 1875.1969 | 1864.9297 | 1890.9342 |
11 | 2.87084 | 5.15534 | 2199.1742 | 2046.5126 | 2031.8171 | 2061.3742 |
12 | 2.83479 | 5.22682 | 2378.5610 | 2216.0897 | 2197.0063 | 2230.0833 |
13 | 2.80066 | 5.29720 | 2555.4324 | 2383.8394 | 2360.5220 | 2397.0479 |
14 | 2.76827 | 5.36667 | 2729.6307 | 2549.6814 | 2522.3854 | 2562.2546 |
15 | 2.73744 | 5.43540 | 2901.1841 | 2713.5676 | 2682.6150 | 2725.6895 |
16 | 2.70803 | 5.50352 | 3070.0592 | 2875.4173 | 2841.2267 | 2887.3382 |
17 | 2.67993 | 5.57113 | 3236.1740 | 3035.1281 | 2998.2341 | 3047.1862 |
18 | 2.65302 | 5.63835 | 3399.6110 | 3192.6858 | 3153.6493 | 3205.2185 |
19 | 2.62723 | 5.70525 | 3560.2392 | 3347.9912 | 3307.4827 | 3361.4200 |
20 | 2.60246 | 5.77192 | 3718.1861 | 3501.0196 | 3459.7432 | 3515.7748 |
21 | 2.57865 | 5.83843 | 3873.3936 | 3651.7224 | 3610.4388 | 3668.2670 |
22 | 2.55574 | 5.90483 | 4025.8546 | 3800.0255 | 3759.5765 | 3818.8802 |
23 | 2.53366 | 5.97118 | 4175.6781 | 3945.8947 | 3907.1623 | 3967.5974 |
24 | 2.51238 | 6.03754 | 4322.7440 | 4089.3093 | 4053.2015 | 4114.4016 |
25 | 2.49183 | 6.10394 | 4467.2432 | 4230.1963 | 4197.6986 | 4259.2749 |
26 | 2.47199 | 6.17045 | 4609.0505 | 4368.5789 | 4340.6574 | 4402.1993 |
27 | 2.45280 | 6.23709 | 4748.3528 | 4504.3843 | 4482.0808 | 4543.1562 |
28 | 2.43424 | 6.30390 | 4885.0752 | 4637.5912 | 4621.9708 | 4682.1265 |
29 | 2.41627 | 6.37093 | 5019.3102 | 4768.2049 | 4760.3286 | 4819.0909 |
30 | 2.39886 | 6.43822 | 5151.0976 | 4896.2160 | 4897.1540 | 4954.0292 |
31 | 2.38198 | 6.50581 | 5280.4957 | 5021.6199 | 5032.4453 | 5086.9209 |
32 | 2.36559 | 6.57373 | 5407.6584 | 5144.3987 | 5166.1996 | 5217.7451 |
33 | 2.34968 | 6.64203 | 5532.5226 | 5264.5739 | 5298.4115 | 5346.4801 |
34 | 2.33421 | 6.71075 | 5655.2732 | 5382.1512 | 5429.0739 | 5473.1037 |
35 | 2.31916 | 6.77995 | 5775.9516 | 5497.1711 | 5558.1767 | 5597.5934 |
36 | 2.30449 | 6.84968 | 5894.7729 | 5609.6559 | 5685.7071 | 5719.9256 |
37 | 2.29019 | 6.92001 | 6011.7216 | 5719.6579 | 5811.6486 | 5840.0767 |
38 | 2.27622 | 6.99099 | 6127.0372 | 5827.1948 | 5935.9808 | 5958.0219 |
39 | 2.26255 | 7.06271 | 6240.8901 | 5932.3405 | 6058.6790 | 6073.7360 |
40 | 2.24915 | 7.13525 | 6353.4619 | 6035.1462 | 6179.7135 | 6187.1933 |
41 | 2.23599 | 7.20872 | 6464.9443 | 6135.6961 | 6299.0486 | 6298.3671 |