File name: Pandora85s1_NewOrleansLA-XULA_20240818_L2Fit_fout2c2d20230315p1-8.txt File generation date: 20240819T061209.6Z Data description: Level 2 spectral fitting results file Data file version: fout2c2p1-8 Local principal investigator: Morewell Gasseller Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 85 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora85_OF_v3d20231120.txt Instrument calibration file used: Pandora85s1_CF_v2d20240315.txt Level 1 file used: Pandora85s1_NewOrleansLA-XULA_20240818_L1_smca1c2d20230315p1-8.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: 20240818 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: OOB session based on clearance session 1 First and last pixel inside fitting window: 196 339 Nominal wavelengths inside fitting window [nm]: 305.0087 305.1493 305.2899 305.4305 305.5710 305.7116 305.8522 305.9927 306.1332 306.2737 306.4143 306.5547 306.6952 306.8357 306.9762 307.1166 307.2571 307.3975 307.5379 307.6783 307.8187 307.9591 308.0994 308.2398 308.3801 308.5205 308.6608 308.8011 308.9414 309.0817 309.2220 309.3623 309.5025 309.6428 309.7830 309.9232 310.0634 310.2036 310.3438 310.4840 310.6242 310.7643 310.9045 311.0446 311.1847 311.3248 311.4649 311.6050 311.7451 311.8851 312.0252 312.1652 312.3053 312.4453 312.5853 312.7253 312.8653 313.0052 313.1452 313.2851 313.4251 313.5650 313.7049 313.8448 313.9847 314.1246 314.2644 314.4043 314.5442 314.6840 314.8238 314.9636 315.1034 315.2432 315.3830 315.5227 315.6625 315.8022 315.9420 316.0817 316.2214 316.3611 316.5008 316.6404 316.7801 316.9198 317.0594 317.1990 317.3386 317.4782 317.6178 317.7574 317.8970 318.0365 318.1761 318.3156 318.4551 318.5947 318.7342 318.8736 319.0131 319.1526 319.2920 319.4315 319.5709 319.7103 319.8497 319.9891 320.1285 320.2679 320.4073 320.5466 320.6859 320.8253 320.9646 321.1039 321.2432 321.3825 321.5217 321.6610 321.8002 321.9395 322.0787 322.2179 322.3571 322.4963 322.6355 322.7746 322.9138 323.0529 323.1921 323.3312 323.4703 323.6094 323.7485 323.8875 324.0266 324.1656 324.3047 324.4437 324.5827 324.7217 324.8607 324.9997 --------------------------------------------------------------------------------------- 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: 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 77: 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 78: 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 79: 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 80: 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 81: 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 82: Atmospheric variability [%], 999=no atmospheric variability was determined Column 83: Wavelength effective temperature [°C], 999=no effective temperature given Column 84: Estimated average residual stray light level [%] (only valid for stray light correction methods 2 and higher) Column 85: Retrieved wavelength shift from L1 data [nm], -9=no wavelength change determination Column 86: Retrieved total wavelength shift [nm], -9=no wavelength change fitting Column 87: Number of bright count cycles Column 88: Number of dark count cycles Column 89: Effective position of filterwheel #1, 0=filterwheel not used, 1-9 are valid positions Column 90: Effective position of filterwheel #2, 0=filterwheel not used, 1-9 are valid positions Column 91: Sum over 2^i, 0=spectra were interpolated in time, 1=spectra are corrected for off-target signal Column 92: Integration time [ms] Column 93: Temperature at electronics board [°C], 999=no temperature signal 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: Humidity in head sensor [%], -9=no humidity signal Column 98: Pressure in head sensor [hPa], -9=no pressure signal Columns 99-242: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 243-386: 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 20240818T121353.2Z 8996.509644 189 1 53.80 2 81.57 80.00 117.14 258.18 0.00 1 0.00 1 0 17 6.227e-01 2.590e-02 1.912e-01 4.324e-03 7.252478e-01 2.444504e-03 8.040083e-03 -6.000000e+00 3.636754e-01 229.45 -2.00 3.24 -2.00 321.33 0.00e+00 -2.228925e-03 1.318977e-03 6.520215e-03 -6.000000e+00 2.585946e-02 294.53 -2.00 20.00 -2.00 320.64 0.00e+00 6.409 0.003 302.00 328.00 3 1.7586e+00 9.1409e-03 8.1863e-02 -6.0000e+00 8.9832e-01 2.7128e-01 1.2630e-02 6.1261e-02 -6.0000e+00 9.7798e-01 -5.1033e-01 1.1796e-02 1.9216e-02 -6.0000e+00 5.8622e-01 2.1252e-01 5.5832e-03 9.5379e-03 -6.0000e+00 2.5553e-01 8.2689e-05 -7.6786e-04 1.2293e-04 6.9031e-05 -6.0000e+00 1.8393e-02 -2.8381e-02 12 8 8 10 0 0 18.49 27.21 0.81 -0.02838 -0.03415 48 5 1 5 0 1120.640 34.50 20.01 27.21 34.68 21.0 1014.51 900000 900000 214323 900000 -180819 900000 -200604 -141416 -201654 -186085 900000 900000 900000 900000 238524 900000 -92700 212587 65085 900000 900000 -25621 38503 81654 -21391 900000 900000 900000 900000 900000 -87302 900000 -28151 -27287 -36693 -8520 4378 -23687 23921 83433 131104 95663 194998 1608 6715 -7342 137547 64617 -4266 63991 27059 82543 2372 -853 53290 34388 2337 13105 12670 -10248 -2662 39934 -8304 -9445 6211 30584 -10393 15717 469 8915 20117 15247 -6975 9329 5482 -3 -12414 -4632 -1721 7996 -5195 -88 -6259 -11256 2896 2699 -165 431 3762 -1067 4911 2988 -2641 -2721 -177 -3744 -1448 -315 -1338 -2546 -106 -3117 -2145 -1336 -1537 -2835 -2462 711 733 827 791 3927 3066 1648 -738 -1781 -92 -2569 -1463 125 1972 1720 3038 351 303 371 -2695 -1117 -895 797 -415 -139 -344 321 -501 -20 -542 1216 570 1068 854 -1238 -1004 -823 900000 900000 901 900000 -3316 900000 -4216 -1837 -5471 -4835 900000 900000 900000 900000 1003 900000 -2727 894 520 900000 900000 -549 437 652 -530 900000 900000 900000 900000 900000 -4807 900000 -1207 -1319 -1990 -329 153 -1244 945 2244 2590 2975 2377 140 556 -701 3122 3096 -423 3389 2263 4475 320 -131 5174 4278 419 2165 2066 -2020 -478 4884 -1832 -2410 1514 6016 -3014 3554 131 2593 6020 4742 -2791 3087 1758 -1 -4258 -1407 -533 2601 -2096 -39 -3422 -7062 1680 1687 -113 307 2652 -718 3243 1876 -1663 -1692 -114 -2638 -1166 -292 -1328 -2748 -110 -3109 -2067 -1183 -1405 -2836 -2592 772 796 999 1083 5392 4492 2457 -1093 -2537 -125 -3659 -2172 195 3097 2659 4453 512 427 505 -3662 -1578 -1255 1259 -701 -258 -685 631 -1061 -46 -1218 2744 1317 2435 1859 -2741 -2089 -1667 SS 20240818T122726.2Z 8996.519053 194 1 53.82 2 78.68 81.61 119.87 259.56 0.00 1 0.00 1 0 17 3.171e-01 1.521e-02 6.492e-02 1.973e-03 5.728846e-01 1.024090e-03 6.762879e-03 -6.000000e+00 1.822200e-01 229.45 -2.00 3.24 -2.00 320.24 0.00e+00 9.100808e-04 3.830587e-04 4.328726e-03 -6.000000e+00 8.566925e-03 294.53 -2.00 20.00 -2.00 319.40 0.00e+00 4.915 0.001 302.00 328.00 3 1.9562e+00 3.1749e-03 5.9961e-02 -6.0000e+00 4.5209e-01 -1.4269e-02 3.9825e-03 3.9960e-02 -6.0000e+00 4.8995e-01 -6.7417e-02 3.4151e-03 1.4571e-02 -6.0000e+00 2.9318e-01 2.0739e-02 1.7456e-03 4.9788e-03 -6.0000e+00 1.2509e-01 3.2791e-04 -3.7947e-04 5.4389e-05 5.5026e-05 -6.0000e+00 8.6332e-03 -2.9317e-02 12 8 8 10 0 0 28.91 27.33 0.63 -0.02932 -0.03217 89 10 1 5 0 604.590 34.50 20.01 27.33 35.69 21.1 1014.64 900000 -53938 -84828 -78170 -113212 900000 -152437 -112923 -134598 -124588 -28396 -3892 59054 34931 -30841 131531 -37615 -6708 6939 8275 12044 -20978 -16807 8703 -25766 35633 20958 49782 4201 37588 -36474 19917 -12122 -12781 -23937 -21906 -10918 -14473 -3854 5165 14031 5523 12057 -1949 61 1885 11816 6177 -2523 3909 2616 9273 1157 -2294 7030 3552 1824 1277 1379 -3517 -223 6144 -157 1074 3867 4641 -2376 1803 -151 1784 4985 3450 -1487 1735 437 -1455 -5039 -3831 -4248 -1592 -3217 -2015 -2924 -3979 -274 726 377 1283 2718 1039 1878 463 -614 -2551 -770 -3312 -291 245 470 -34 -481 -1837 -2236 -2359 -994 -1956 -1113 132 310 1047 1461 2502 2521 1532 -31 -936 -508 -737 32 426 1077 611 1203 717 94 110 -1601 -1149 -522 -36 -436 -487 -655 -723 -671 -33 -170 560 801 743 251 -192 -556 -300 900000 -424 -1023 -1007 -1938 900000 -3753 -2107 -3599 -3403 -317 -36 341 322 -688 708 -1273 -185 183 231 341 -839 -656 285 -1308 1055 758 1350 172 1099 -2483 912 -891 -1074 -2307 -1972 -914 -1436 -417 629 1846 874 1904 -336 11 323 2061 1054 -484 733 536 1988 298 -668 2022 1115 607 439 469 -1225 -75 2048 -62 435 1677 2028 -1072 775 -69 899 2793 1973 -923 1023 246 -823 -2666 -1896 -2169 -899 -2008 -1438 -2211 -3289 -231 655 340 1202 2574 996 1702 424 -532 -2176 -673 -3113 -306 276 563 -44 -607 -2189 -2577 -2549 -1100 -2364 -1323 165 414 1431 2209 3873 4050 2455 -49 -1380 -760 -1124 48 683 1783 1008 1912 1112 141 168 -2386 -1658 -790 -58 -739 -854 -1217 -1406 -1321 -65 -359 1199 1746 1613 526 -383 -1107 -583 SS 20240818T123327.6Z 8996.523236 197 1 54.10 2 77.38 82.32 121.08 260.18 0.00 1 0.00 1 0 25 2.118e-01 1.451e-02 3.772e-02 1.858e-03 5.252522e-01 9.557205e-04 6.091675e-03 -6.000000e+00 1.217289e-01 229.45 -2.00 3.24 -2.00 319.84 0.00e+00 1.518989e-03 3.127759e-04 3.123881e-03 -6.000000e+00 5.722508e-03 294.53 -2.00 20.00 -2.00 318.96 0.00e+00 4.449 0.001 302.00 328.00 3 2.3486e+00 2.8326e-03 5.2826e-02 -6.0000e+00 3.0202e-01 -1.9752e-02 3.4396e-03 3.1640e-02 -6.0000e+00 3.2728e-01 -3.7106e-02 2.7776e-03 1.3079e-02 -6.0000e+00 1.9585e-01 6.9834e-03 1.4515e-03 3.6118e-03 -6.0000e+00 8.3578e-02 3.5695e-04 -3.6308e-04 5.1506e-05 4.4701e-05 -6.0000e+00 5.7667e-03 -3.0524e-02 12 8 8 10 0 0 69.90 27.40 0.51 -0.03052 -0.03325 71 8 1 5 0 761.950 34.50 20.01 27.40 35.99 21.0 1014.69 900000 -16806 -36385 -46630 -94805 900000 -99601 -68267 -96601 -109818 -39605 22335 33909 1631 -26010 37385 -31265 -918 -11480 19884 13346 -14021 -11992 4703 -16637 15500 9703 35253 1177 18861 -22644 7217 -11376 -8713 -18299 -8954 -10330 -13047 -3946 6755 11040 5639 10479 -527 -122 -93 10939 3769 -1359 2977 2305 6844 -779 -2315 5996 2934 706 462 936 -3072 97 4594 310 650 2687 3361 -2363 877 -675 1816 4436 2637 -1239 1597 836 -1323 -4016 -4132 -3416 -1609 -3212 -1248 -2257 -3701 -632 443 155 901 2489 1406 1861 712 -1112 -2890 -1191 -2813 -707 629 271 73 -213 -1213 -2302 -1838 -887 -1535 -1092 -258 561 1129 1598 2607 2188 1431 -88 -782 -510 -639 -246 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