File name: Pandora143s1_LibertyTX_20250413_L2Fit_fout2c9d20230920p1-8.txt File generation date: 20250414T062851.2Z Data description: Level 2 spectral fitting results file Data file version: fout2c9p1-8 Local principal investigator: Yuxuan Wang Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 143 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora143_OF_v1d20230920.txt Instrument calibration file used: Pandora143s1_CF_v9d20230920.txt Level 1 file used: Pandora143s1_LibertyTX_20250413_L1_smca1c9d20230920p1-8.txt Full location name: Sam Houston Regional Library and Research Center Short location name: LibertyTX Country of location: United States Location latitude [deg]: 30.0965 Location longitude [deg]: -94.7635 Location altitude [m]: 3 Local noon date: 20250413 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are latency correction, matrix method stray light correction (replaced by simple method) Data caveats: None First and last pixel inside fitting window: 242 384 Nominal wavelengths inside fitting window [nm]: 305.0307 305.1715 305.3123 305.4532 305.5940 305.7348 305.8756 306.0164 306.1572 306.2979 306.4387 306.5794 306.7201 306.8609 307.0016 307.1423 307.2829 307.4236 307.5643 307.7049 307.8456 307.9862 308.1268 308.2674 308.4080 308.5486 308.6892 308.8297 308.9703 309.1108 309.2513 309.3919 309.5324 309.6729 309.8133 309.9538 310.0943 310.2347 310.3752 310.5156 310.6560 310.7964 310.9368 311.0772 311.2175 311.3579 311.4982 311.6386 311.7789 311.9192 312.0595 312.1998 312.3401 312.4804 312.6206 312.7609 312.9011 313.0413 313.1815 313.3217 313.4619 313.6021 313.7423 313.8824 314.0226 314.1627 314.3028 314.4429 314.5830 314.7231 314.8632 315.0033 315.1433 315.2834 315.4234 315.5634 315.7034 315.8434 315.9834 316.1234 316.2633 316.4033 316.5432 316.6831 316.8231 316.9630 317.1029 317.2427 317.3826 317.5225 317.6623 317.8022 317.9420 318.0818 318.2216 318.3614 318.5012 318.6409 318.7807 318.9204 319.0602 319.1999 319.3396 319.4793 319.6190 319.7587 319.8983 320.0380 320.1776 320.3173 320.4569 320.5965 320.7361 320.8757 321.0153 321.1548 321.2944 321.4339 321.5734 321.7129 321.8524 321.9919 322.1314 322.2709 322.4104 322.5498 322.6892 322.8287 322.9681 323.1075 323.2469 323.3862 323.5256 323.6650 323.8043 323.9436 324.0829 324.2223 324.3616 324.5008 324.6401 324.7794 324.9186 --------------------------------------------------------------------------------------- Column 1: Two letter code of measurement routine Column 2: UT date and time for center-time of measurement, yyyymmddThhmmssZ (ISO 8601) Column 3: Fractional days since 1-Jan-2000 midnight for center-time of measurement Column 4: Routine count (1 for the first routine of the day, 2 for the second, etc.) Column 5: Repetition count (1 for the first set in the routine, 2 for the second, etc.) Column 6: Total duration of measurement set in seconds Column 7: Data processing type index Column 8: Solar zenith angle for center-time of measurement in degree Column 9: Solar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 10: Lunar zenith angle for center-time of measurement in degree Column 11: Lunar azimuth for center-time of measurement in degree, 0=north, increases clockwise Column 12: Pointing zenith angle in degree, absolute or relative (see next column), 999=tracker not used Column 13: Zenith pointing mode: zenith angle is... 0=absolute, 1=relative to sun, 2=relative to moon Column 14: Pointing azimuth in degree, increases clockwise, absolute (0=north) or relative (see next column), 999=tracker not used Column 15: Azimuth pointing mode: like zenith angle mode but also fixed scattering angles relative to sun (3) or moon (4) Column 16: Fitting result index: 0=no error or warning, 1, 2=warning, >2=error Column 17: Number of function evaluations used, 0=linear fitting or fitting not successful or no fitting done Column 18: rms of unweighted fitting residuals, -9=fitting not successful Column 19: Normalized rms of fitting residuals weighted with independent uncertainty, -9=fitting not successful or no uncertainty used Column 20: Expected rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 21: Expected normalized weighted rms based on independent uncertainty, -9=fitting not successful or no uncertainty given Column 22: Ozone slant column amount [moles per square meter], -9e99=fitting not successful Column 23: Independent uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 24: Structured uncertainty of ozone slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 25: Common uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 26: rms-based uncertainty of ozone slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 27: Ozone effective temperature [K] Column 28: Independent uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 29: Structured uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 30: Common uncertainty of ozone effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 31: Effective ozone fitting wavelength [nm], -9=fitting not successful Column 32: Diffuse correction applied before fitting at effective fitting wavelength for ozone [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 33: Sulfur dioxide slant column amount [moles per square meter], -9e99=fitting not successful Column 34: Independent uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 35: Structured uncertainty of sulfur dioxide slant column amount [moles per square meter], -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 36: Common uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -6=no common uncertainty input was given, -7=not given since method "MEAS" was chosen, -9=spectral fitting not successful Column 37: rms-based uncertainty of sulfur dioxide slant column amount [moles per square meter], -1=cross section is zero in this wavelength range, -3=spectral fitting was done, but no rms-based uncertainty could be retrieved, -9=spectral fitting not successful Column 38: Sulfur dioxide effective temperature [K] Column 39: Independent uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no independent uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -5=no independent uncertainty input was given, -9=spectral fitting not successful Column 40: Structured uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -9=spectral fitting not successful Column 41: Common uncertainty of sulfur dioxide effective temperature [K], -1=temperature fitting was requested, but cross section is zero in this wavelength range, -2=no temperature fitting was requested and output for effective temperature and structured uncertainty of it is based on f-code, -3=spectral fitting was done, but no common uncertainty could be retrieved, -4=temperature fitting was requested, but differential optical depth is too small to retrieve the temperature, -6=no common uncertainty input was given, -9=spectral fitting not successful Column 42: Effective sulfur dioxide fitting wavelength [nm], -9=fitting not successful Column 43: Diffuse correction applied before fitting at effective fitting wavelength for sulfur dioxide [%], 0=no diffuse correction applied or fitting not requested, >0=measured diffuse correction, <0=(negative value of) calculated diffuse correction Column 44: Molecular scattering air mass factor used for molecular scattering subtraction before the fitting Column 45: Estimated uncertainty of molecular scattering air mass factor, -9=molecular scattering was not subtracted before the fitting Column 46: Lower limit used for wavelength scaling [nm] Column 47: Upper limit used for wavelength scaling [nm] Column 48: Order of smoothing polynomial Column 49: Smoothing polynomial coefficient, order 0 Column 50: Independent uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 51: Structured uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 52: Common uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 53: rms-based uncertainty of smoothing polynomial coefficient, order 0, -9=fitting not successful Column 54: Smoothing polynomial coefficient, order 1 Column 55: Independent uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 56: Structured uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 57: Common uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 58: rms-based uncertainty of smoothing polynomial coefficient, order 1, -9=fitting not successful Column 59: Smoothing polynomial coefficient, order 2 Column 60: Independent uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 61: Structured uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 62: Common uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 63: rms-based uncertainty of smoothing polynomial coefficient, order 2, -9=fitting not successful Column 64: Smoothing polynomial coefficient, order 3 Column 65: Independent uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 66: Structured uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 67: Common uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 68: rms-based uncertainty of smoothing polynomial coefficient, order 3, -9=fitting not successful Column 69: Mean value of measured data inside fitting window [same units as measurements] Column 70: Wavelength change polynomial coefficient, order 0 Column 71: Independent uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 72: Structured uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 73: Common uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 74: rms-based uncertainty of wavelength change polynomial coefficient, order 0, -9=fitting not successful Column 75: L1 based wavelength change coefficient, order 0, -9=no L1 wavelength change determination Column 76: L1 based wavelength change coefficient, order 1, -9=no L1 wavelength change determination Column 77: L2Fit data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 78: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ1 limit, 0=L1 data quality above 0, 1=Spectral fitting was not successful, 2=Wavelength shift too large, 3=Normalized rms of fitting residuals weighted with independent uncertainty too large Column 79: Sum over 2^i using those i, for which the corresponding L2Fit data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 80: L1 data quality flag: 0=assured high quality, 1=assured medium quality, 2=assured low quality, 10=not-assured high quality, 11=not-assured medium quality, 12=not-assured low quality Column 81: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ1 limit, 0=Saturated data, 1=Too few dark counts measurements, 2=No temperature given or effective temperature too different from the reference temperature, 3=Dark count too high, 4=Unsuccessful dark background fitting, 5=The dark count differs significantly from the dark map for too many pixels, 6=Absolute value of estimated average residual stray light level too high, 7=Although attempted, no wavelength change could be retrieved, 8=Absolute value of retrieved wavelength shift too large, 9=Retrieved wavelength shift differs too much from the shift predicted by the effective temperature Column 82: Sum over 2^i using those i, for which the corresponding L1 data quality parameter exceeds the DQ2 limit (same parameters as for DQ1) Column 83: Atmospheric variability [%], 999=no atmospheric variability was determined Column 84: Wavelength effective temperature [°C], 999=no effective temperature given Column 85: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 86: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 87: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 88: Number of bright count cycles Column 89: Number of dark count cycles Column 90: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 91: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 92: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 93: Integration time [ms] Column 94: Spectrometer control temperature [°C], 999=no temperature signal Column 95: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 96: Temperature in head sensor [°C], 999=no temperature signal Column 97: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: Normalized slant column residuals weighted with independent instrumental uncertainty for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting, 0=no independent instrumental uncertainty was given --------------------------------------------------------------------------------------- SS 20250413T125027.5Z 9234.535041 195 1 28.00 2 78.73 85.76 100.70 259.54 0.00 1 0.00 1 0 25 4.489e-01 2.834e-02 3.175e-01 1.302e-02 6.123317e-01 6.987404e-03 6.740400e-03 -6.000000e+00 2.536902e-01 229.28 -2.00 3.25 -2.00 321.02 0.00e+00 5.951829e-04 3.090036e-03 3.698560e-03 -6.000000e+00 1.256898e-02 287.67 -2.00 20.00 -2.00 320.37 0.00e+00 4.939 0.001 302.00 328.00 3 3.5238e+00 2.3284e-02 6.0717e-02 -6.0000e+00 6.3520e-01 2.3149e-01 3.0741e-02 4.0087e-02 -6.0000e+00 6.9269e-01 -3.1498e-01 2.7487e-02 1.7248e-02 -6.0000e+00 4.0910e-01 1.2306e-01 1.3326e-02 4.7047e-03 -6.0000e+00 1.7712e-01 5.6948e-05 -7.0798e-04 3.5162e-04 5.4230e-05 -6.0000e+00 1.1270e-02 1.9833e-03 0.0000e+00 12 8 8 10 0 0 99.97 24.26 0.47 0.00198 -0.00334 11 11 5 8 0 2545.400 20.00 24.26 23.06 25.90 26.21 27.9 1027.74 900000 900000 -118434 -48115 900000 132753 -67228 7442 900000 -158029 -73741 -44998 900000 -141121 6753 -52839 24693 -125277 900000 -31365 228622 99154 34653 14898 -39876 900000 -53909 900000 -63922 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-2026 1998 337 971 -2908 -2129 2584 -1019 502 2119 -1438 -536 -868 -1413 -4513 963 3273 -5026 1868 1113 2450 3433 -903 2418 -814 -2663 -2206 1365 -2203 -773 860 -8184 -1562 -2053 -2458 -4149 -1008 -1161 -1307 3 -1803 -1638 1503 -2274 3675 -3315 4440 2535 1864 -1240 -1090 3569 4145 3420 614 885 2223 3355 1720 -789 -1945 3372 -616 264 2215 -806 -529 -1355 3303 -4670 2313 -1240 -4561 SS 20250413T125712.0Z 9234.539722 198 1 25.99 2 77.27 86.58 102.10 260.30 0.00 1 0.00 1 0 25 5.444e-01 2.548e-02 2.212e-01 8.683e-03 5.517426e-01 4.573409e-03 6.479054e-03 -6.000000e+00 3.056381e-01 229.28 -2.00 3.25 -2.00 320.61 0.00e+00 2.611835e-03 1.802089e-03 3.840757e-03 -6.000000e+00 1.535645e-02 287.67 -2.00 20.00 -2.00 319.92 0.00e+00 4.415 0.001 302.00 328.00 3 3.4739e+00 1.4394e-02 5.4677e-02 -6.0000e+00 7.6482e-01 1.4894e-01 1.8389e-02 3.6542e-02 -6.0000e+00 8.3190e-01 -2.3147e-01 1.6078e-02 1.6215e-02 -6.0000e+00 4.9185e-01 1.0138e-01 8.0204e-03 3.8923e-03 -6.0000e+00 2.1323e-01 1.0614e-04 -1.0762e-03 2.3339e-04 5.6926e-05 -6.0000e+00 1.3495e-02 3.7425e-03 0.0000e+00 12 8 8 10 0 0 99.93 24.23 0.35 0.00374 -0.00434 13 13 5 8 0 1998.940 20.01 24.23 23.31 25.90 26.21 27.9 1029.53 -76460 900000 -118249 14907 900000 900000 65790 -5228 900000 -115181 900000 -108256 900000 -127822 900000 -44127 42055 -66728 900000 -26715 40390 49956 15977 278373 -44688 99072 -7853 402964 -45061 12884 -324 19461 76733 89418 93678 -26261 96502 -70181 63909 7691 12548 -4410 12338 14450 16322 5325 11210 26032 2625 11464 1291 15255 15743 19539 7617 22374 9346 1212 12742 -2788 10595 -8558 4552 4212 2202 911 13952 -2094 3267 4232 822 3844 -3685 6887 -1708 358 -1568 6854 -2724 3599 -623 -1314 -189 -3715 -2407 -1020 331 -5195 2172 1783 1489 847 -541 -25 -2348 -1543 -2604 195 -594 489 -2035 -3829 -6188 1037 -1779 -2547 -1669 -874 -936 925 199 -263 917 -723 2921 -1140 3430 564 1431 -619 -338 1370 870 1635 -223 1577 1120 2888 210 1635 -139 275 -864 323 279 -765 -417 -508 851 -796 920 -1015 -1446 -1319 900000 -3818 133 900000 900000 556 -55 900000 -4232 900000 -3931 900000 -8344 900000 -1899 885 -4241 900000 -1307 1082 1201 533 2354 -3094 1855 -410 3407 -3088 516 -17 981 2588 2920 2806 -2311 2789 -11572 3628 891 1558 -688 1719 2017 2251 830 1676 3422 441 1836 247 2844 3187 4103 1886 5000 2444 343 3148 -776 2630 -2751 1456 1515 861 350 4481 -774 1242 1849 412 1970 -2026 3299 -824 153 -620 2443 -1138 1656 -346 -829 -129 -2751 -1857 -830 281 -4803 1890 1522 1205 641 -389 -18 -1845 -1363 -2627 216 -724 604 -2442 -4230 -6377 1005 -1902 -2919 -1971 -1072 -1222 1304 307 -428 1484 -1148 4256 -1634 4699 822 2188 -1012 -556 2173 1338 2443 -329 2217 1505 3828 311 2665 -247 508 -1648 637 580 -1683 -934 -1154 1926 -1796 1962 -2083 -2865 SS 20250413T130324.2Z 9234.544030 200 1 6.17 2 75.93 87.34 103.39 260.99 0.00 1 0.00 1 0 25 3.554e-01 2.055e-02 2.680e-01 1.317e-02 4.984911e-01 6.716597e-03 5.462926e-03 -6.000000e+00 1.977607e-01 229.28 -2.00 3.25 -2.00 320.12 0.00e+00 1.258718e-03 2.312487e-03 1.371935e-03 -6.000000e+00 9.200149e-03 287.67 -2.00 20.00 -2.00 319.40 0.00e+00 4.022 0.001 302.00 328.00 3 3.2492e+00 2.0075e-02 4.7261e-02 -6.0000e+00 4.9416e-01 7.4353e-03 2.4900e-02 2.5548e-02 -6.0000e+00 5.3602e-01 -3.3848e-02 2.1558e-02 1.2527e-02 -6.0000e+00 3.1806e-01 1.2552e-02 1.1071e-02 3.4755e-03 -6.0000e+00 1.3743e-01 2.1136e-04 -6.6650e-04 3.4615e-04 3.6556e-05 -6.0000e+00 8.7151e-03 -3.0403e-03 0.0000e+00 12 9 9 12 1 1 999.00 24.20 0.36 -0.00304 -0.00805 2 13 5 8 0 2054.150 19.99 24.20 23.53 25.90 26.21 27.9 1031.11 166743 -104622 73091 -22555 900000 -87421 -38195 -108421 900000 -132467 -36172 -89100 900000 -57461 132455 141199 -41261 -10662 57657 -4309 -31714 37184 -47435 28735 -18538 44793 2071 95956 -17904 -11637 -12375 40463 41908 41669 29220 -28792 29804 -45400 19476 18960 -851 -2310 -5389 13650 1572 3093 -2836 17532 -353 12972 -8396 2578 3293 7493 3617 9760 6682 2167 8585 -11107 7619 -3047 -3081 5384 4256 445 3675 -849 4690 5787 -804 -983 -2989 4138 -1971 1445 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