File name: Pandora30s1_Juelich_20200807_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T154235.3Z 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_20200807_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: 20200807 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 20200807T045701.1Z 7524.206263 200 1 48.24 2 84.01 71.46 66.94 222.65 0.00 1 0.00 1 0 25 7.490e-01 7.291e-02 2.185e-01 1.435e-02 8.981025e-01 8.306879e-03 1.100884e-02 -6.000000e+00 4.436379e-01 232.75 -2.00 3.80 -2.00 321.62 0.00e+00 -2.427423e-02 2.611070e-03 2.391111e-03 -6.000000e+00 2.026968e-02 283.43 -2.00 20.00 -2.00 320.95 0.00e+00 8.535 0.013 302.00 328.00 3 9.3063e-01 2.6157e-02 1.0399e-01 -6.0000e+00 1.1176e+00 1.7454e+00 3.0683e-02 7.3928e-02 -6.0000e+00 1.2078e+00 -2.0175e+00 1.8398e-02 2.4671e-02 -6.0000e+00 7.1606e-01 7.1609e-01 9.9333e-03 2.1607e-02 -6.0000e+00 3.0755e-01 1.7109e-05 -4.2883e-04 3.9451e-04 2.8920e-04 -6.0000e+00 2.0798e-02 3.8270e-05 0.0000e+00 12 8 8 10 0 0 -6.33 21.32 0.19 0.00004 -0.00318 44 10 1 5 0 1096.190 26.62 19.99 21.32 26.53 33.3 1009.11 211969 86720 -3321 900000 175619 28948 -53683 5381 900000 16046 17388 41305 900000 127849 28345 101332 674 126793 900000 5306 53241 355147 278499 -32516 134488 197608 -4088 150121 -86148 900000 102672 64032 -1098 21046 -11497 43715 25497 226128 900000 26651 900000 84273 105291 117505 -14356 108493 41115 900000 -31370 900000 900000 -27345 -787 117781 88447 48377 53628 56854 -43157 212351 178280 64499 -1390 48895 -17692 11398 14851 -39914 13498 26722 74575 23625 10306 -3387 -13371 95092 -34018 35862 87817 -27691 58152 14653 -8006 22334 22865 11026 40403 25430 20162 -23734 27812 18926 11273 19229 4813 873 -1140 7413 -4812 -11891 -7054 11216 17084 -4937 -18645 -12527 352 -9311 4265 5946 307 -208 -10954 -526 2348 -3039 -6412 1866 -3396 5622 9292 1154 5322 5246 8451 3060 -7444 3211 -5710 1081 1231 2922 -833 2332 -3203 -245 2223 2018 1827 761 -4293 -2685 4986 6662 -543 900000 3486 2082 -8890 601 900000 1939 2052 3779 900000 5545 3325 6257 107 5872 900000 715 4344 4960 3890 -6403 5932 5060 -657 4776 -20512 900000 4222 4048 -136 2212 -1504 3053 2249 3334 900000 4016 900000 7929 7663 7294 -2707 6145 4080 900000 -6068 900000 900000 -6474 -154 8408 8517 7326 7884 7774 -13803 5583 6298 7057 -309 7224 -4954 2421 3035 -14188 3344 6620 12335 6617 2994 -1024 -4118 9149 -10603 5773 10153 -10868 11927 5055 -3790 8282 8958 5113 15207 10602 8603 -14768 10120 7193 4657 8043 2568 568 -878 5980 -4461 -11578 -5986 7378 9902 -3717 -16543 -11015 304 -9246 4218 6688 411 -298 -16871 -746 3114 -4189 -9438 2673 -5402 8222 12583 1613 6934 6664 10117 3737 -10214 4470 -9759 1976 2483 6234 -1990 5609 -8746 -674 6047 5527 4864 1911 -10929 -6323 SS 20200807T050648.5Z 7524.213061 203 1 48.91 2 82.54 73.31 67.96 224.98 0.00 1 0.00 1 0 17 4.933e-01 3.108e-02 1.904e-01 5.282e-03 8.223013e-01 2.976407e-03 9.893133e-03 -6.000000e+00 2.885154e-01 232.75 -2.00 3.80 -2.00 321.89 0.00e+00 -5.985908e-03 1.591184e-03 1.899972e-03 -6.000000e+00 1.247496e-02 283.43 -2.00 20.00 -2.00 321.39 0.00e+00 7.125 0.008 302.00 328.00 3 1.0497e+00 1.1230e-02 8.6448e-02 -6.0000e+00 7.2684e-01 7.2293e-01 1.4520e-02 5.0335e-02 -6.0000e+00 7.8575e-01 -1.2096e+00 1.2122e-02 2.5856e-02 -6.0000e+00 4.6574e-01 5.1404e-01 5.7190e-03 7.9686e-03 -6.0000e+00 1.9708e-01 7.9686e-05 -4.5315e-04 1.4540e-04 1.2129e-04 -6.0000e+00 1.3037e-02 -2.9970e-04 0.0000e+00 12 8 8 10 0 0 -9.61 21.32 0.29 -0.00030 -0.00370 120 28 1 5 0 404.120 26.62 20.01 21.32 27.21 33.3 1009.19 71218 -75552 -107943 14602 47228 -81894 -163107 -61120 15950 -94630 -107205 -67957 241949 1029 -44873 -23401 -49083 -5255 900000 -62047 31800 93859 138112 -52155 29182 103773 -52083 77170 -96882 77507 34014 30498 32296 -3887 37083 2257 23015 69354 101367 39698 149625 58841 49935 78059 1506 81957 31210 98827 7064 12510 97412 -3871 31566 52994 51802 36357 37093 41458 -7722 53333 40851 35927 16050 25443 8619 8961 15131 -8588 13275 12431 22178 8934 7426 2641 -4485 18587 -11828 6642 14624 -7515 7488 236 -3431 1051 3778 -1420 6620 2571 3518 -7676 4000 3021 -3424 3146 -2999 -2322 -3947 -1809 -5647 -7240 17588 -2631 1339 -4561 -6180 -5109 -2260 -2809 -422 872 -1504 -456 -2679 -975 -197 -1423 -1465 -791 646 1013 2962 1277 2834 3394 3262 2567 -307 2760 -470 1197 703 1125 311 825 -322 -78 889 270 56 -517 -2233 -2116 433 -2193 -4345 157 310 -1763 -8169 -1230 164 -3101 -4015 -1813 1246 19 -1575 -756 -2206 -160 900000 -3427 670 1112 1067 -2685 724 1389 -2926 1192 -7120 1117 876 871 1028 -186 1203 90 877 1964 2558 2007 3082 2865 2688 3416 125 3292 1885 3409 579 1042 4263 -475 2970 4366 4583 3931 4080 4269 -1225 4369 3824 3868 2404 3906 1638 1661 2642 -2014 2840 3096 5461 2585 2113 728 -1186 3480 -2862 1408 3334 -2579 2611 93 -1543 481 1804 -759 3420 1408 1879 -4364 1893 1377 -1665 1564 -1852 -1684 -3409 -1757 -5652 -7237 13652 -2225 1021 -3855 -5746 -4972 -2286 -3128 -481 1130 -2233 -708 -4272 -1482 -286 -2056 -2195 -1250 1065 1682 4658 1949 4135 4783 4467 3415 -423 4135 -849 2244 1452 2473 738 2102 -829 -207 2371 728 147 -1369 -5565 -4957 SS 20200807T051739.5Z 7524.220597 206 1 49.08 2 80.89 75.35 69.14 227.51 0.00 1 0.00 1 0 17 5.995e-01 1.362e-02 1.271e-01 2.282e-03 7.316495e-01 1.262957e-03 9.043255e-03 -6.000000e+00 3.491231e-01 232.75 -2.00 3.80 -2.00 321.42 0.00e+00 5.067573e-03 6.345780e-04 2.894457e-03 -6.000000e+00 1.510622e-02 283.43 -2.00 20.00 -2.00 320.90 0.00e+00 5.989 0.005 302.00 328.00 3 8.7035e-01 4.4377e-03 7.4290e-02 -6.0000e+00 8.7819e-01 1.5966e-01 6.2405e-03 4.5995e-02 -6.0000e+00 9.4793e-01 -3.2046e-01 6.3280e-03 2.5697e-02 -6.0000e+00 5.6259e-01 1.3831e-01 2.9625e-03 9.1403e-03 -6.0000e+00 2.3923e-01 3.0172e-04 -8.1834e-04 6.1837e-05 1.2450e-04 -6.0000e+00 1.5843e-02 -6.9833e-04 0.0000e+00 12 8 8 10 0 0 6.34 21.32 0.21 -0.00070 -0.00685 259 61 1 5 0 187.290 26.62 20.00 21.32 27.99 33.3 1009.32 -196072 -180222 -234393 -104992 -196184 -165113 -252356 -204901 -54420 -205284 -173497 -166499 63468 -119983 -109798 -60046 -96737 -29651 20097 -59783 -35569 52136 -17191 -73167 -12448 -13492 -48446 -35971 -80041 -5731 9395 -8862 -3336 -10199 -20416 -7111 -21229 17733 13069 3776 25348 7975 11275 12439 5897 14294 14259 23186 34 12466 21816 3776 5710 15991 11122 9287 5455 6907 -3080 6914 13735 8695 8101 7127 4573 5206 3323 -598 2217 3982 4155 3344 1233 1355 -472 2049 -4482 -2306 3588 -3529 1675 -1203 -2388 -834 -186 53 1486 1668 888 -750 1201 -127 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