File name: Pandora30s1_Juelich_20201218_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T160406.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c3p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 30 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora30_OF_v4d20190910.txt Instrument calibration file used: Pandora30s1_CF_v3d20191023.txt Level 1 file used: Pandora30s1_Juelich_20201218_L1_smca1c3d20191023p1-8.txt Full location name: Juelich JULEY Short location name: Juelich Country of location: Germany Location latitude [deg]: 50.9080 Location longitude [deg]: 6.4130 Location altitude [m]: 94 Local noon date: 20201218 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: 219 360 Nominal wavelengths inside fitting window [nm]: 305.0309 305.1726 305.3142 305.4558 305.5975 305.7391 305.8807 306.0223 306.1639 306.3054 306.4470 306.5885 306.7301 306.8716 307.0131 307.1546 307.2961 307.4376 307.5790 307.7205 307.8619 308.0034 308.1448 308.2862 308.4276 308.5690 308.7104 308.8518 308.9931 309.1345 309.2758 309.4171 309.5585 309.6998 309.8411 309.9823 310.1236 310.2649 310.4061 310.5474 310.6886 310.8298 310.9710 311.1122 311.2534 311.3945 311.5357 311.6769 311.8180 311.9591 312.1002 312.2413 312.3824 312.5235 312.6646 312.8057 312.9467 313.0877 313.2288 313.3698 313.5108 313.6518 313.7928 313.9337 314.0747 314.2156 314.3566 314.4975 314.6384 314.7793 314.9202 315.0611 315.2020 315.3428 315.4837 315.6245 315.7653 315.9062 316.0470 316.1877 316.3285 316.4693 316.6101 316.7508 316.8915 317.0323 317.1730 317.3137 317.4544 317.5950 317.7357 317.8764 318.0170 318.1576 318.2983 318.4389 318.5795 318.7201 318.8606 319.0012 319.1418 319.2823 319.4228 319.5634 319.7039 319.8444 319.9849 320.1253 320.2658 320.4062 320.5467 320.6871 320.8275 320.9679 321.1083 321.2487 321.3891 321.5295 321.6698 321.8101 321.9505 322.0908 322.2311 322.3714 322.5117 322.6519 322.7922 322.9324 323.0727 323.2129 323.3531 323.4933 323.6335 323.7737 323.9138 324.0540 324.1941 324.3343 324.4744 324.6145 324.7546 324.8947 --------------------------------------------------------------------------------------- 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 100-241: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 242-383: 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 20201218T082259.0Z 7657.349295 76 1 48.10 2 85.06 137.62 112.22 96.75 0.00 1 0.00 1 0 33 9.741e-01 1.740e-01 2.565e-01 1.888e-02 1.064486e+00 1.097626e-02 2.665634e-02 -6.000000e+00 5.617852e-01 220.65 -2.00 3.80 -2.00 321.33 0.00e+00 5.917592e-02 2.639114e-03 1.692089e-02 -6.000000e+00 2.586976e-02 268.71 -2.00 20.00 -2.00 320.82 0.00e+00 9.937 0.021 302.00 328.00 3 -1.0964e+00 2.9408e-02 1.1481e-01 -6.0000e+00 1.3774e+00 3.0598e+00 3.4870e-02 5.7073e-02 -6.0000e+00 1.5037e+00 -2.4096e+00 2.2491e-02 5.6110e-02 -6.0000e+00 8.9768e-01 8.1299e-01 1.2951e-02 5.0637e-02 -6.0000e+00 3.9725e-01 1.0904e-05 -1.8070e-02 4.0270e-04 4.8143e-04 -6.0000e+00 2.8786e-02 -3.2373e-04 0.0000e+00 12 9 8 11 32 0 -0.61 21.19 0.54 -0.00032 -0.13611 37 9 1 5 0 1299.730 26.51 20.00 21.19 12.69 36.1 1010.39 900000 182029 84595 900000 900000 151328 -16488 69043 900000 -72549 -49012 -127388 900000 -948 -1268 122078 25642 340891 900000 124089 177111 900000 900000 -28716 428847 87606 -62942 258930 -137552 900000 900000 93754 141982 87949 61141 143988 43388 900000 900000 69370 900000 78367 248925 172094 6220 151817 169786 900000 12574 114400 900000 4025 30281 169764 128477 105725 68170 54495 -59359 163988 900000 134348 30985 52018 17316 46925 43113 -16413 16873 62664 96774 86836 12752 24747 -1986 193969 -30053 86814 309201 -35377 139078 32998 9261 41443 43232 31902 83742 52936 45434 -3109 58630 46216 21552 27803 14301 -2765 7497 15102 18397 14810 -63546 58293 46602 11526 -19685 -6247 -5255 -11956 3587 4237 359 1259 -1915 7410 23709 7123 1078 6837 5143 18913 29177 12984 9574 10434 11591 5469 -14781 -10678 -18992 -10009 -894 6703 -323 2165 -6495 577 199 2537 2963 6916 -4540 -5021 900000 10852 15296 900000 900000 10271 -4076 5193 900000 -10647 -4495 -20363 900000 -84 -190 7950 5421 6253 900000 13088 10234 900000 900000 -6597 7867 3806 -9525 4750 -38569 900000 900000 6336 7813 9595 8243 7646 5404 900000 900000 6162 900000 6204 4566 5963 1072 6742 7094 900000 2653 9719 900000 1104 6777 10726 11536 11126 9412 7734 -22431 6852 900000 8078 5744 9291 5066 10828 10198 -6654 5294 13491 16164 16348 4585 7478 -675 8302 -10039 9378 5672 -16580 15732 11979 4519 16204 16863 14230 22719 19881 18292 -1865 18566 15126 8469 10334 6862 -1826 5515 12453 17110 15282 -125786 34837 26185 7696 -17910 -5203 -4497 -11678 3336 4570 451 1765 -2928 10343 28596 9290 1483 9239 7436 25777 34816 16828 11854 12260 13012 6330 -20295 -14573 -31504 -18386 -1743 13455 -749 5003 -17454 1515 529 6579 7573 16970 -11395 -11369 SS 20201218T082827.2Z 7657.353092 79 1 48.37 2 84.48 138.74 111.39 97.72 0.00 1 0.00 1 0 25 7.597e-01 5.814e-02 2.255e-01 1.155e-02 8.847781e-01 6.416750e-03 1.048736e-02 -6.000000e+00 4.298264e-01 220.65 -2.00 3.80 -2.00 321.80 0.00e+00 -2.134357e-02 2.318982e-03 5.414849e-03 -6.000000e+00 1.956919e-02 268.71 -2.00 20.00 -2.00 321.34 0.00e+00 9.145 0.016 302.00 328.00 3 2.0923e-01 2.0103e-02 1.1098e-01 -6.0000e+00 1.0579e+00 1.5991e+00 2.3825e-02 8.1393e-02 -6.0000e+00 1.1556e+00 -1.8844e+00 1.7346e-02 2.6768e-02 -6.0000e+00 6.8578e-01 6.8923e-01 9.4781e-03 1.6930e-02 -6.0000e+00 2.9757e-01 2.2952e-05 1.7728e-04 3.2010e-04 1.7788e-04 -6.0000e+00 2.1255e-02 1.4313e-04 0.0000e+00 12 8 8 10 0 0 11.96 21.19 0.46 0.00014 0.00148 62 15 1 5 0 779.930 26.51 20.00 21.19 13.00 36.1 1010.39 279897 38258 18290 900000 280289 10409 -54968 16722 900000 2931 1652 18468 900000 140632 7539 105714 13050 92683 900000 750 270445 108482 900000 -38185 211568 123310 -4609 900000 -97132 900000 81959 76346 41442 26761 45740 23272 21188 103887 900000 53640 900000 82593 166906 163248 2565 139549 27804 900000 -25653 57526 391230 -21906 22331 75545 103793 45512 64254 39079 -34488 113909 117464 111421 62 54576 -10022 26166 10929 -33246 1707 14455 62789 26891 11368 -455 1686 67429 -30065 51610 57706 -26970 32806 16660 -7535 10460 16286 5849 35017 10016 18765 -18897 16855 6077 5520 12419 3081 -105 -4974 2614 -6441 -11323 -3552 1834 8382 -6252 -11666 -9326 -1003 -6718 1579 3402 -1027 -1143 -7144 -887 1284 -1177 -4003 -170 -1029 4246 9384 2178 5351 1927 6463 1418 -6846 3594 -4086 1214 257 3571 -386 1791 -2251 -50 2054 558 1233 261 -3117 -2809 3146 2983 1593 900000 3150 578 -6216 1069 900000 259 147 1388 900000 3688 752 4435 1302 4375 900000 76 3039 3414 900000 -5767 3170 4619 -577 900000 -20127 900000 3070 3375 2826 2125 2707 1604 1572 3970 900000 4983 900000 6436 5761 5373 357 4929 2666 900000 -4248 4396 4397 -4513 3196 6849 8082 6240 7462 5592 -9328 6767 6506 6977 12 6992 -2523 4450 2170 -10910 446 3790 10914 6790 3194 -130 413 8065 -8447 7209 8755 -10629 8357 5729 -3613 4444 6918 2892 13354 4915 8183 -10579 6567 2536 2353 5462 1738 -67 -3896 2165 -6221 -11198 -2962 1279 5116 -4611 -9801 -8077 -856 -6686 1662 4079 -1364 -1615 -10838 -1232 1782 -1650 -5610 -242 -1552 6080 12972 3075 7126 2589 8072 1799 -9578 5145 -7009 2260 532 7697 -932 4331 -6065 -136 5541 1531 3249 646 -7774 -6570 SS 20201218T083945.2Z 7657.360939 82 1 48.32 2 83.34 141.07 109.68 99.73 0.00 1 0.00 1 0 17 5.873e-01 3.146e-02 2.402e-01 5.794e-03 8.059094e-01 3.135398e-03 9.771198e-03 -6.000000e+00 3.281147e-01 220.65 -2.00 3.80 -2.00 321.77 0.00e+00 7.226781e-03 1.414582e-03 2.093116e-03 -6.000000e+00 1.419780e-02 268.71 -2.00 20.00 -2.00 321.37 0.00e+00 7.860 0.010 302.00 328.00 3 5.3913e-01 1.0256e-02 8.9500e-02 -6.0000e+00 8.0778e-01 9.2067e-01 1.3140e-02 4.6031e-02 -6.0000e+00 8.8307e-01 -1.2577e+00 1.2366e-02 2.6529e-02 -6.0000e+00 5.2402e-01 5.2365e-01 6.2060e-03 1.1434e-02 -6.0000e+00 2.2474e-01 6.3560e-05 -1.5735e-03 1.5815e-04 1.6209e-04 -6.0000e+00 1.5498e-02 -5.7445e-04 0.0000e+00 12 9 8 11 8 0 -11.59 21.18 0.29 -0.00057 -0.01240 101 24 1 5 0 478.280 26.51 20.00 21.18 13.60 36.0 1010.44 137239 -34471 -47973 162466 111075 -68682 -156885 -84474 120298 -93502 -112872 -75380 900000 10070 -33125 1351 -25235 80734 900000 -19761 65258 160130 107451 -58615 117468 87297 -50076 103679 -98406 250898 82699 39221 62948 6033 12014 9085 18060 80888 105241 29106 254092 60282 62150 89057 4360 73722 42465 99045 3604 14362 94783 -4332 31597 49867 55806 27831 31901 34208 -17551 45525 53683 44586 6623 29216 8756 12019 12705 -10658 9728 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