Table G.1
Input data format required for the Python package.
| TIPS | Theoretical values | Observed values | |||||||
|---|---|---|---|---|---|---|---|---|---|
| T[K] | Q(T) | Branch | Jl | gl | El [cm−1] | Branch | Jl | Nl [×1010cm 2] | σNl [×1010cm−2] |
| 1 | 21.0874 | P | 0 | 15 | 0.0000 | P | 2 | 2.3100 | 0.2560 |
| 2 | 36.8237 | P | 1 | 63 | 1.6318 | P | 8 | 12.5000 | 0.9710 |
| 3 | 52.3739 | P | 2 | 75 | 4.8951 | Q | 6 | 5.1000 | 0.3700 |
| 4 | 67.6863 | ⋮ | ⋮ | ⋮ | ⋮ | Q | 10 | 6.9500 | 0.8500 |
| 5 | 82.9647 | Q | 0 | 15 | 0.0000 | R | 0 | 0.4560 | 0.0455 |
| 6 | 98.2533 | Q | 1 | 63 | 1.6318 | R | 2 | 4.0000 | 0.2720 |
| 7 | 113.5546 | Q | 2 | 75 | 4.8951 | R | 4 | 8.3800 | 0.8540 |
| 8 | 128.8651 | ⋮ | ⋮ | ⋮ | ⋮ | R | 6 | 9.7800 | 0.8940 |
| 9 | 144.1822 | R | 0 | 15 | 0.0000 | R | 8 | 9.7800 | 0.7870 |
| 10 | 159.5040 | R | 1 | 63 | 1.6318 | R | 10 | 10.3000 | 1.0200 |
| 11 | 174.8293 | R | 2 | 75 | 4.8951 | R | 16 | 5.4800 | 0.5930 |
| ⋮ | ⋮ | ⋮ | ⋮ | ⋮ | ⋮ | R | 28 | 1.8600 | 0.1570 |
Notes. The table includes precomputed partition functions (TIPS) with temperature (T) and Q(T), theoretical values such as transition branches, rotational quantum numbers (Jl), degeneracy factors (gl), and energy levels (El), as well as observed values including column densities (Nl) and their uncertainties (σNl). These inputs allow the package to perform spectral analysis using both the RD and χ2 fitting methods. The values provided in this table are pseudo data for 13C2D2, with even parity.
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