File name: Pandora143s1_LibertyTX_20250509_L2Fit_fout2c9d20230920p1-8.txt File generation date: 20250510T063314.9Z 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_20250509_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: 20250509 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 20250509T124117.2Z 9260.528672 162 1 27.49 2 75.91 77.70 128.91 285.71 0.00 1 0.00 1 0 17 2.946e-01 1.012e-02 1.583e-01 3.982e-03 5.390729e-01 2.033473e-03 5.850101e-03 -6.000000e+00 1.641866e-01 230.71 -2.00 3.25 -2.00 320.21 0.00e+00 2.298255e-03 7.235436e-04 1.121435e-03 -6.000000e+00 7.414531e-03 289.55 -2.00 20.00 -2.00 319.47 0.00e+00 4.016 0.001 302.00 328.00 3 2.7269e+00 6.1566e-03 4.8227e-02 -6.0000e+00 4.1051e-01 3.5057e-02 7.7248e-03 2.6947e-02 -6.0000e+00 4.4412e-01 -5.1614e-02 6.8538e-03 1.3785e-02 -6.0000e+00 2.6508e-01 1.8084e-02 3.5102e-03 4.2384e-03 -6.0000e+00 1.1523e-01 3.3439e-04 -8.0535e-04 1.0274e-04 4.2231e-05 -6.0000e+00 7.0463e-03 -8.3196e-03 0.0000e+00 12 9 8 11 8 0 99.16 22.52 0.21 -0.00832 -0.01437 22 22 5 8 0 1249.520 20.00 22.52 25.44 25.90 26.21 29.0 1032.84 -68997 900000 -87599 -27097 955 156655 -120587 109518 -104629 -42052 1123 -84565 14805 -48765 97668 -51870 47770 -40757 76482 -25319 26139 -56 -13724 -8520 -18103 10875 -10060 35418 -38707 6491 -17439 27212 -4766 31192 10915 -16868 4901 -23133 8746 -1854 7807 -6558 3437 -3741 7809 -2710 5754 -1010 376 1632 -560 4322 5794 6062 -742 5558 3 339 250 -200 -430 1975 2024 3390 2512 -292 2902 -2432 3034 1610 1843 321 13 -10 -347 -1566 -175 -127 0 1265 -1885 86 -1489 -1829 -1412 -329 -290 -291 515 603 768 -223 332 105 1535 -877 370 -185 -113 -1149 71 -1247 -1646 -174 -747 -985 -862 -223 -523 -171 -150 65 511 -7 1035 215 1155 124 260 -468 41 175 720 377 433 599 85 1151 78 897 -293 -64 -677 -168 60 167 -305 212 114 -184 85 -327 -527 -831 900000 -1654 -289 7 608 -2781 425 -2770 -672 12 -2179 177 -1346 837 -2199 883 -1897 1273 -1174 780 -2 -604 -385 -985 482 -557 1241 -2641 292 -1104 1345 -371 1909 785 -1490 371 -2677 926 -261 1140 -1180 592 -710 1343 -526 1051 -199 75 334 -126 1037 1501 1686 -233 1708 1 114 83 -65 -141 682 782 1445 1153 -134 1230 -1066 1354 838 1063 197 8 -6 -196 -813 -82 -58 0 692 -1220 61 -1169 -1508 -1219 -298 -276 -289 508 585 709 -194 270 84 1303 -849 396 -220 -146 -1532 90 -1467 -1788 -186 -854 -1195 -1081 -289 -716 -252 -238 107 848 -11 1584 317 1669 187 409 -776 69 287 1140 584 653 878 119 1601 117 1476 -519 -117 -1272 -327 121 354 -663 463 251 -402 179 -659 -1026 SS 20250509T124752.3Z 9260.533244 165 1 28.00 2 74.52 78.45 130.24 286.80 0.00 1 0.00 1 0 25 4.761e-01 3.066e-02 2.375e-01 1.196e-02 4.971416e-01 6.216814e-03 5.822497e-03 -6.000000e+00 2.669286e-01 230.71 -2.00 3.25 -2.00 319.97 0.00e+00 1.634391e-03 1.992792e-03 2.907874e-03 -6.000000e+00 1.342738e-02 289.55 -2.00 20.00 -2.00 319.20 0.00e+00 3.677 0.001 302.00 328.00 3 5.8446e+00 1.8374e-02 4.5931e-02 -6.0000e+00 6.6656e-01 2.0801e-01 2.2468e-02 3.0232e-02 -6.0000e+00 7.2235e-01 -1.4737e-01 1.8622e-02 1.3397e-02 -6.0000e+00 4.2938e-01 5.7548e-02 9.6768e-03 3.3890e-03 -6.0000e+00 1.8963e-01 1.9727e-05 -4.8931e-04 3.2049e-04 4.0428e-05 -6.0000e+00 1.1851e-02 -8.3245e-03 0.0000e+00 12 9 8 11 8 0 79.75 22.54 0.57 -0.00832 -0.01200 7 7 2 8 0 4000.000 20.01 22.54 25.58 25.90 26.21 29.0 1034.34 900000 900000 -44988 -48573 900000 900000 163003 323838 30704 -47485 900000 -45949 900000 -55884 900000 157326 126064 -53511 183138 1716 30669 134905 -33044 37068 21801 64957 -13136 90641 -52628 47105 22469 38252 27380 65946 110047 -41193 37055 -69959 4175 7087 19034 -15977 5285 33221 14956 2410 7707 5919 -3525 -1165 2009 10333 22996 20736 3086 9033 9381 -5577 11225 -9080 9639 1560 -186 6169 59 2366 565 673 -3411 8112 2129 8090 -3992 1641 -5816 -2394 -5131 -3909 1638 -1950 1431 -3051 3317 -4123 2664 -2185 3715 -918 -557 1460 2199 3563 -506 1965 -1266 -671 -973 -550 -1674 -1579 1116 -2728 -6955 -1425 -1910 -4847 2182 -2209 -256 521 1268 -1743 1207 479 -933 1276 2591 -1644 1276 -566 236 3932 1054 354 14 1969 403 4157 -15 882 -1879 264 273 -1426 1932 428 -703 -215 1457 -1410 69 153 -2522 900000 900000 -1228 -1350 900000 900000 1899 3773 449 -1576 900000 -1561 900000 -2996 900000 1833 1880 -4703 2134 100 1407 2271 -2752 1693 1255 2630 -1134 2801 -6042 2079 1382 2368 2150 3907 4110 -6086 2716 -16573 600 1185 3195 -3992 1126 5535 2973 546 1676 1311 -866 -287 514 2705 5790 5717 1056 3016 3228 -2218 3714 -3529 3167 593 -80 2786 30 1134 258 300 -1682 4148 1280 4844 -2682 1007 -3567 -1284 -2552 -1846 772 -1098 901 -2247 2513 -3497 2238 -2041 3481 -929 -564 1421 2010 2974 -407 1505 -1070 -634 -1034 -652 -2188 -2108 1384 -3174 -7657 -1489 -2158 -5979 2622 -2879 -345 760 1991 -2942 1986 762 -1411 1792 3545 -2411 1929 -917 386 6094 1616 531 21 2719 534 5288 -21 1384 -3235 464 489 -2694 3744 882 -1494 -460 3106 -3027 140 294 -4762 SS 20250509T141827.1Z 9260.596147 207 1 24.00 2 55.07 88.87 147.31 307.33 0.00 1 0.00 1 0 17 9.659e-02 2.657e-02 4.273e-02 1.134e-02 2.486320e-01 5.611714e-03 2.909341e-03 -6.000000e+00 5.383422e-02 230.72 -2.00 3.25 -2.00 317.38 0.00e+00 -1.124792e-03 8.335769e-04 8.919680e-04 -6.000000e+00 2.414679e-03 289.56 -2.00 20.00 -2.00 316.52 0.00e+00 1.741 0.000 302.00 328.00 3 7.8023e+00 1.4945e-02 2.1368e-02 -6.0000e+00 1.3460e-01 6.8831e-02 1.6884e-02 1.3104e-02 -6.0000e+00 1.4561e-01 2.2961e-02 1.0222e-02 5.7171e-03 -6.0000e+00 8.6833e-02 -1.3213e-02 5.1303e-03 2.3046e-03 -6.0000e+00 3.7539e-02 2.6976e-05 5.4358e-04 2.9725e-04 2.0168e-05 -6.0000e+00 2.3085e-03 -9.6299e-03 0.0000e+00 12 9 8 11 8 0 -10.85 22.52 0.81 -0.00963 -0.00555 6 6 2 8 0 4000.000 20.01 22.52 27.89 25.90 26.21 29.2 1051.51 18514 20490 -1357 -15470 73741 29023 7276 12809 -324 580 -9513 -14065 3273 -3952 5723 7006 -3930 -17472 20020 -7758 6370 10767 5885 -2436 -1079 9020 -2728 9490 -16542 3832 9816 5381 310 37210 12175 -9867 3055 -30541 2029 -337 784 -5603 2627 7447 1497 -1484 -635 -6287 -4872 -3004 4247 -3129 7658 5233 -2626 4456 4088 -3484 2248 -1736 -2528 451 2236 3078 -1227 1116 610 -4093 -823 4172 669 2900 1220 2714 1079 -2612 -945 -3547 77 -1830 -378 -1632 1504 -2071 -708 1092 2127 1812 900 1534 1674 -358 -3604 -285 -2753 -1837 -528 1178 1237 -2301 100 -4121 -3152 -3873 -531 -1608 695 -1960 847 1440 1020 597 455 -1391 2307 226 -156 -1358 -439 -1053 677 3389 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