File name: Pandora85s1_NewOrleansLA-XULA_20260328_L2Fit_fout2c6d20250326p1-8.txt File generation date: 20260329T061159.7Z Data description: Level 2 spectral fitting results file Data file version: fout2c6p1-8 Local principal investigator: Morewell Gasseller Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 85 Spectrometer number: 1 Processing software version used: BlickP v1.8.88 Instrument operation file used: Pandora85_OF_v3d20231120.txt Instrument calibration file used: Pandora85s1_CF_v6d20250326.txt Level 1 file used: Pandora85s1_NewOrleansLA-XULA_20260328_L1_smca1c6d20250326p1-8.txt Full location name: Xavier University of Louisiana Short location name: NewOrleansLA-XULA Country of location: United States Location latitude [deg]: 29.9643 Location longitude [deg]: -90.1074 Location altitude [m]: 10 Local noon date: 20260328 Notes on s-number (L1 configuration): Corrections NOT applied although requested by the s-number are dark map for dark correction (replaced by immediate dark method), latency correction, matrix method stray light correction (replaced by simple method) Data caveats: OOB session based on clearance session 3 First and last pixel inside fitting window: 196 338 Nominal wavelengths inside fitting window [nm]: 305.0210 305.1616 305.3022 305.4428 305.5834 305.7240 305.8645 306.0051 306.1456 306.2862 306.4267 306.5672 306.7077 306.8481 306.9886 307.1291 307.2695 307.4099 307.5504 307.6908 307.8312 307.9716 308.1119 308.2523 308.3927 308.5330 308.6733 308.8136 308.9540 309.0943 309.2345 309.3748 309.5151 309.6553 309.7956 309.9358 310.0760 310.2162 310.3564 310.4966 310.6368 310.7769 310.9171 311.0572 311.1973 311.3375 311.4776 311.6176 311.7577 311.8978 312.0379 312.1779 312.3179 312.4580 312.5980 312.7380 312.8780 313.0179 313.1579 313.2978 313.4378 313.5777 313.7176 313.8576 313.9974 314.1373 314.2772 314.4171 314.5569 314.6968 314.8366 314.9764 315.1162 315.2560 315.3958 315.5356 315.6753 315.8151 315.9548 316.0945 316.2342 316.3739 316.5136 316.6533 316.7930 316.9326 317.0723 317.2119 317.3515 317.4911 317.6307 317.7703 317.9099 318.0494 318.1890 318.3285 318.4681 318.6076 318.7471 318.8866 319.0261 319.1655 319.3050 319.4444 319.5839 319.7233 319.8627 320.0021 320.1415 320.2809 320.4202 320.5596 320.6989 320.8383 320.9776 321.1169 321.2562 321.3955 321.5347 321.6740 321.8133 321.9525 322.0917 322.2309 322.3701 322.5093 322.6485 322.7877 322.9268 323.0660 323.2051 323.3442 323.4834 323.6225 323.7615 323.9006 324.0397 324.1787 324.3178 324.4568 324.5958 324.7348 324.8738 --------------------------------------------------------------------------------------- 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: Temperature at electronics board [°C], 999=no temperature signal Column 95: Spectrometer control temperature [°C], 999=no temperature signal Column 96: Auxiliary spectrometer temperature [°C], 999=no temperature signal Column 97: Temperature in head sensor [°C], 999=no temperature signal Column 98: Humidity in head sensor [%], -9=no humidity signal Column 99: Pressure in head sensor [hPa], -9=no pressure signal Columns 100-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-385: 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 20260328T125503.4Z 9583.538234 173 1 53.96 2 77.72 93.51 125.47 329.24 0.00 1 0.00 1 0 25 2.328e-01 1.024e-02 8.578e-02 2.536e-03 5.243619e-01 1.366066e-03 6.752600e-03 -6.000000e+00 1.357140e-01 228.06 -2.00 3.24 -2.00 320.70 0.00e+00 3.776810e-03 5.679718e-04 5.611900e-03 -6.000000e+00 6.050156e-03 286.66 -2.00 20.00 -2.00 320.05 0.00e+00 4.563 0.001 302.00 328.00 3 1.7544e+00 4.3947e-03 5.8105e-02 -6.0000e+00 3.3696e-01 9.1463e-04 5.6601e-03 4.2459e-02 -6.0000e+00 3.6403e-01 -5.5596e-02 5.2180e-03 1.8767e-02 -6.0000e+00 2.1736e-01 1.1425e-02 2.5822e-03 4.1114e-03 -6.0000e+00 9.3672e-02 5.6465e-04 6.4452e-05 7.5871e-05 1.0442e-04 -6.0000e+00 6.4845e-03 -8.2925e-03 0.0000e+00 12 8 8 10 0 0 40.51 24.58 0.49 -0.00829 -0.00781 109 12 1 5 0 494.980 32.75 20.00 24.58 22.52 4.5 989.17 -99246 -93568 -69510 -85212 -76772 -85928 -76958 623 -58915 -74078 -57133 -46179 -53658 -32246 -29316 3918 -33810 7970 -15003 -10642 -17927 -17223 -2699 -20860 -1818 -20914 -18426 -18557 -8730 -11200 -4333 -9876 2641 -3807 -13970 -7637 -2524 -457 -5879 2463 2690 401 2974 2241 4235 3583 2508 1960 505 -1824 3205 143 1748 4886 1999 2055 2366 527 -454 630 1952 1565 1760 4936 3296 1538 -317 -774 -306 629 1928 2566 1526 932 740 -1479 -3113 -4625 -4368 -2779 -2157 -1956 -1492 -1616 -712 35 485 1179 1918 1530 827 48 -2063 -2023 -1674 -1525 -357 385 1173 -155 -801 -1358 -2354 -1880 -643 -1704 -937 -546 126 1160 1763 1786 1307 599 -202 -1257 -685 -61 506 1083 681 538 758 951 -28 -357 -1257 -1049 -150 -499 -416 -769 -691 -894 -18 -151 -216 923 740 333 143 -116 -579 -1026 -1094 -703 -1015 -777 -908 -779 3 -623 -999 -681 -529 -796 -486 -534 62 -882 151 -388 -280 -528 -558 -77 -769 -59 -874 -779 -776 -320 -432 -177 -498 135 -230 -926 -459 -154 -31 -515 240 301 50 381 301 568 494 356 285 76 -295 533 27 358 1051 473 506 599 137 -118 159 496 429 538 1638 1194 561 -113 -278 -115 265 906 1283 785 468 348 -645 -1256 -1821 -1801 -1294 -1165 -1207 -1020 -1181 -549 29 422 1063 1748 1379 708 38 -1583 -1515 -1322 -1356 -360 401 1351 -187 -939 -1483 -2365 -1992 -712 -1861 -1069 -660 162 1617 2693 2926 2188 982 -316 -1871 -989 -90 785 1779 1157 902 1233 1498 -43 -524 -1792 -1475 -225 -834 -762 -1519 -1430 -1776 -38 -337 -504 2174 1778 791 326 -253 -1214 SS 20260328T130024.7Z 9583.541952 176 1 53.94 2 76.56 94.20 126.04 330.55 0.00 1 0.00 1 0 25 1.509e-01 1.023e-02 6.570e-02 2.206e-03 4.866776e-01 1.172921e-03 6.062174e-03 -6.000000e+00 8.795832e-02 228.06 -2.00 3.24 -2.00 320.47 0.00e+00 2.831140e-03 4.478830e-04 4.474494e-03 -6.000000e+00 3.920980e-03 286.66 -2.00 20.00 -2.00 319.80 0.00e+00 4.197 0.001 302.00 328.00 3 1.9293e+00 3.6487e-03 5.2062e-02 -6.0000e+00 2.1839e-01 -1.6535e-02 4.5933e-03 3.5861e-02 -6.0000e+00 2.3593e-01 -2.6083e-02 4.0983e-03 1.6000e-02 -6.0000e+00 1.4087e-01 -2.3315e-03 2.0602e-03 3.6185e-03 -6.0000e+00 6.0714e-02 7.0101e-04 1.9116e-04 6.6201e-05 8.3390e-05 -6.0000e+00 4.2025e-03 -8.7892e-03 0.0000e+00 12 8 8 10 0 0 57.23 24.60 0.52 -0.00879 -0.00735 121 13 1 5 0 445.750 32.75 20.00 24.60 22.80 4.5 990.47 -54863 -24390 -36701 -42027 -66862 -71701 -18335 -60573 -15554 -41849 -38954 -47035 -49888 -13297 5089 -14736 -14580 -9203 -553 -13686 -318 -11112 -3065 -9113 -2562 -4639 -10837 -10305 -14364 -11271 -10106 -2140 -5709 -3177 -8807 -8933 -5442 -7250 -8266 2222 -1678 1416 -637 -350 2491 3345 1157 1028 166 -536 1228 890 2262 4996 1760 969 2391 659 1342 -95 556 1578 3183 4396 3514 1141 334 -1538 107 1032 1790 1657 1897 1683 -61 -890 -2598 -3659 -4003 -2610 -2108 -1873 -1940 -2085 -1006 -221 621 1119 1698 1686 1345 -273 -2086 -1885 -1734 -1018 -834 515 1001 228 -806 -1365 -2653 -1440 -818 -1161 -1054 -468 356 881 1762 2063 1423 914 -572 -963 -647 -87 353 852 244 482 900 669 104 -349 -1505 -937 -146 -334 -508 -727 -800 -1009 -258 36 62 729 873 361 75 -176 -552 -515 -200 -373 -452 -850 -911 -143 -805 -149 -573 -541 -754 -976 -224 88 -369 -452 -295 -18 -527 -11 -437 -114 -386 -109 -214 -550 -512 -714 -553 -548 -124 -391 -233 -676 -663 -416 -650 -903 264 -238 211 -102 -58 409 554 199 179 30 -100 243 195 533 1239 481 277 696 198 394 -28 165 495 1095 1666 1435 469 132 -617 44 478 928 921 1072 925 -32 -427 -1152 -1568 -1794 -1315 -1228 -1241 -1427 -1639 -832 -195 525 982 1508 1475 1226 -234 -1704 -1491 -1440 -942 -800 555 1192 283 -972 -1536 -2761 -1431 -855 -1310 -1249 -585 472 1265 2750 3428 2410 1509 -904 -1434 -935 -129 549 1406 417 816 1475 1067 159 -516 -2163 -1319 -218 -553 -921 -1413 -1492 -1965 -529 79 141 1682 2048 840 168 -376 -1139 SS 20260328T130614.0Z 9583.545995 179 1 54.12 2 75.30 94.95 126.64 332.01 0.00 1 0.00 1 0 25 1.187e-01 9.962e-03 2.979e-02 1.464e-03 4.529505e-01 7.675884e-04 5.612761e-03 -6.000000e+00 6.921167e-02 228.06 -2.00 3.24 -2.00 320.06 0.00e+00 2.428303e-03 2.582717e-04 3.446561e-03 -6.000000e+00 3.085404e-03 286.66 -2.00 20.00 -2.00 319.36 0.00e+00 3.860 0.001 302.00 328.00 3 1.6730e+00 2.2555e-03 4.6464e-02 -6.0000e+00 1.7185e-01 -2.7809e-02 2.7630e-03 2.9270e-02 -6.0000e+00 1.8565e-01 -1.1759e-02 2.3727e-03 1.3566e-02 -6.0000e+00 1.1085e-01 -6.0845e-03 1.2246e-03 3.3273e-03 -6.0000e+00 4.7772e-02 1.2960e-03 5.0608e-05 4.3482e-05 5.5093e-05 -6.0000e+00 3.3069e-03 -8.4805e-03 0.0000e+00 12 8 8 10 0 0 91.83 24.62 0.48 -0.00848 -0.00810 174 19 1 5 0 311.020 32.75 20.00 24.62 22.94 4.5 990.87 -44857 -33412 -41807 -34207 -39937 -44172 -26877 -34195 -38026 -41963 -36064 -31915 -26653 -14213 -14200 -13058 -9920 -6272 -4012 -6649 -3617 -4912 -4922 -2316 -5852 -6156 -1577 -7713 -5402 -7510 -414 -3516 -443 -2099 -8038 -9405 -5915 -1055 -1043 808 312 737 782 1457 1418 2120 1798 -182 370 399 1422 1586 622 1558 1454 1958 1285 143 135 384 1309 1280 2822 4015 2791 301 26 -1571 -466 1073 1248 1547 1287 1280 439 -1393 -2827 -3820 -4003 -2542 -1860 -1345 -1400 -2129 -839 92 372 880 1528 1555 766 65 -1428 -1755 -1858 -1533 -481 866 851 20 -717 -1085 -2206 -1693 -906 -1321 -908 -307 229 989 1881 1898 1482 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