File name: Pandora21s1_Bremen_20210210_L2Fit_fout2c12d20201116p1-8.txt File generation date: 20250430T192649.3Z Data description: Level 2 spectral fitting results file Data file version: fout2c12p1-8 Local principal investigator: Tom Hanisco Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 21 Spectrometer number: 1 Processing software version used: BlickP v1.8.75 Instrument operation file used: Pandora21_OF_v4d20190904.txt Instrument calibration file used: Pandora21s1_CF_v12d20201116.txt Level 1 file used: Pandora21s1_Bremen_20210210_L1_smca1c12d20201116p1-8.txt Full location name: Bremen University Short location name: Bremen Country of location: Germany Location latitude [deg]: 53.0813 Location longitude [deg]: 8.8126 Location altitude [m]: 50 Local noon date: 20210210 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: None First and last pixel inside fitting window: 286 428 Nominal wavelengths inside fitting window [nm]: 305.0633 305.2039 305.3445 305.4851 305.6257 305.7662 305.9068 306.0473 306.1878 306.3283 306.4688 306.6093 306.7497 306.8902 307.0306 307.1711 307.3115 307.4519 307.5923 307.7326 307.8730 308.0134 308.1537 308.2940 308.4343 308.5747 308.7149 308.8552 308.9955 309.1357 309.2760 309.4162 309.5564 309.6966 309.8368 309.9770 310.1172 310.2573 310.3975 310.5376 310.6777 310.8178 310.9579 311.0980 311.2380 311.3781 311.5181 311.6582 311.7982 311.9382 312.0782 312.2182 312.3581 312.4981 312.6380 312.7779 312.9179 313.0578 313.1976 313.3375 313.4774 313.6172 313.7571 313.8969 314.0367 314.1765 314.3163 314.4561 314.5959 314.7356 314.8754 315.0151 315.1548 315.2945 315.4342 315.5739 315.7135 315.8532 315.9928 316.1325 316.2721 316.4117 316.5513 316.6908 316.8304 316.9700 317.1095 317.2490 317.3885 317.5280 317.6675 317.8070 317.9465 318.0859 318.2254 318.3648 318.5042 318.6436 318.7830 318.9224 319.0617 319.2011 319.3404 319.4798 319.6191 319.7584 319.8977 320.0369 320.1762 320.3155 320.4547 320.5939 320.7331 320.8723 321.0115 321.1507 321.2899 321.4290 321.5682 321.7073 321.8464 321.9855 322.1246 322.2637 322.4028 322.5418 322.6808 322.8199 322.9589 323.0979 323.2369 323.3759 323.5148 323.6538 323.7927 323.9317 324.0706 324.2095 324.3484 324.4872 324.6261 324.7650 324.9038 --------------------------------------------------------------------------------------- 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 20210210T074154.8Z 7711.320774 79 1 49.68 2 84.21 123.13 85.15 141.77 0.00 1 0.00 1 0 17 5.311e-01 2.866e-02 4.903e-01 2.603e-02 1.143402e+00 1.613678e-02 1.357847e-02 -6.000000e+00 3.174989e-01 223.17 -2.00 3.88 -2.00 322.46 0.00e+00 -2.008036e-03 6.972002e-03 1.903285e-03 -6.000000e+00 1.303487e-02 265.83 -2.00 20.00 -2.00 322.11 0.00e+00 8.811 0.015 302.00 328.00 3 4.0645e-01 5.3416e-02 1.1039e-01 -6.0000e+00 7.8857e-01 1.8535e+00 6.7407e-02 6.6888e-02 -6.0000e+00 8.6231e-01 -2.0043e+00 6.4152e-02 3.8342e-02 -6.0000e+00 5.0383e-01 7.4023e-01 3.4061e-02 1.3766e-02 -6.0000e+00 2.1065e-01 1.5086e-05 -2.6782e-03 7.3234e-04 2.2859e-04 -6.0000e+00 1.6585e-02 3.5211e-03 5.4351e-05 12 8 8 10 0 0 95.13 22.11 0.77 0.00352 -0.01660 40 8 1 5 0 1241.657 25.17 19.99 22.11 2.60 21.9 1012.48 900000 -43940 -61961 -54948 183332 -59527 900000 900000 -97802 -45860 -63531 -112425 900000 -60621 -52469 -9857 130459 900000 111917 4394 -68926 -41795 42522 115517 37838 -26613 140882 -87919 57386 900000 900000 169344 61277 100315 25099 11695 145647 -41067 28274 -45376 87027 21972 17945 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1298 -961 -3856 -4284 -6119 1951 -906 887 1204 762 3200 -1729 -4354 -2096 -35 -3615 411 3330 1654 -5692 -5456 1066 -264 -723 -1357 -3795 981 -3271 755 -934 -1562 -840 1109 1992 -406 2189 6411 2615 -1336 5658 3824 2604 -1235 -1654 2048 845 -4706 95 5708 876 1791 -2745 -2129 1238 43 192 -4650 SS 20210210T075206.2Z 7711.327850 82 1 50.43 2 82.94 125.27 84.24 143.86 0.00 1 0.00 1 0 25 6.236e-01 2.307e-02 3.244e-01 1.009e-02 1.014759e+00 6.286579e-03 1.204070e-02 -6.000000e+00 3.751203e-01 223.17 -2.00 3.88 -2.00 322.35 0.00e+00 1.272139e-02 2.928777e-03 1.829058e-03 -6.000000e+00 1.705940e-02 265.83 -2.00 20.00 -2.00 322.01 0.00e+00 7.494 0.009 302.00 328.00 3 6.5023e-01 2.1132e-02 9.5582e-02 -6.0000e+00 9.3302e-01 1.1307e+00 3.0093e-02 6.0310e-02 -6.0000e+00 1.0250e+00 -1.4220e+00 3.3011e-02 3.4536e-02 -6.0000e+00 6.0295e-01 5.7853e-01 1.6033e-02 1.2364e-02 -6.0000e+00 2.5245e-01 5.4732e-05 -2.8116e-03 3.0882e-04 2.0629e-04 -6.0000e+00 1.9179e-02 3.0763e-03 3.1122e-05 12 8 8 10 0 0 57.26 22.11 0.52 0.00308 -0.01805 94 18 1 5 0 530.802 25.17 20.00 22.11 3.39 21.9 1016.75 900000 -125580 900000 -188540 900000 -137036 160905 -135502 -3053 -63193 -130243 900000 -142512 900000 -97301 900000 -105589 900000 -45383 900000 900000 -60197 900000 -73861 900000 -79588 211400 -48433 39544 -60784 -7542 88318 26339 900000 -50121 900000 -3896 122641 13253 85806 50044 55894 299295 -5088 900000 16124 83452 19904 130319 60418 47169 75990 49935 104000 24006 175449 14354 34677 21635 46882 27203 31364 63899 10993 47986 19755 46965 6483 30470 4122 24080 20076 14690 16803 3622 19448 -3179 18019 -5630 9565 2178 -589 2373 -1091 5652 -3472 7286 -7230 4741 -3148 -1516 -2701 -856 3927 -5401 -274 -7531 -820 -3707 541 -68 732 -1283 -3445 915 -4919 -934 -3994 -1440 -2741 -324 -1918 -1401 -724 -1079 1286 -1139 391 -915 2021 -151 2245 1371 934 2706 488 4593 257 1877 -500 1656 -105 1274 77 -159 533 -226 470 -935 255 -1048 231 -1581 900000 -2671 900000 -6549 900000 -2354 1579 -2106 -30 -620 -1918 900000 -3614 900000 -2786 900000 -4578 900000 -1225 900000 900000 -1674 900000 -2235 900000 -2474 2075 -1124 388 -1690 -168 946 611 900000 -2337 900000 -122 1204 449 1608 1474 1646 2938 -266 900000 699 2085 912 2326 2372 2161 3187 2737 3898 1924 3444 1292 2468 1663 2684 1914 2309 3920 1322 4396 2488 4610 930 4112 756 3964 3562 2684 2779 610 2688 -478 2476 -1046 1863 553 -180 788 -404 2065 -1460 2866 -3368 1951 -1355 -606 -1036 -319 1483 -2581 -149 -4937 -592 -3104 453 -55 529 -840 -2174 611 -3418 -662 -3170 -1253 -2808 -375 -2517 -1936 -1004 -1474 1674 -1521 533 -1324 2917 -219 3011 1752 1155 3193 573 5098 312 2564 -824 3077 -220 2864 188 -420 1472 -644 1343 -2684 696 -2686 536 -3492 SS 20210210T080330.1Z 7711.335765 85 1 50.21 2 81.57 127.68 83.28 146.21 0.00 1 0.00 1 0 25 7.974e-01 1.158e-02 3.121e-01 4.853e-03 9.289626e-01 2.811708e-03 1.095120e-02 -6.000000e+00 4.685087e-01 223.17 -2.00 3.88 -2.00 322.07 0.00e+00 6.008835e-03 1.276909e-03 1.543493e-03 -6.000000e+00 1.961369e-02 265.83 -2.00 20.00 -2.00 321.72 0.00e+00 6.424 0.006 302.00 328.00 3 7.7890e-01 9.2283e-03 8.3893e-02 -6.0000e+00 1.1627e+00 3.4706e-01 1.5633e-02 5.7086e-02 -6.0000e+00 1.2694e+00 -4.1597e-01 1.9561e-02 3.4975e-02 -6.0000e+00 7.4603e-01 1.6625e-01 9.1473e-03 1.2682e-02 -6.0000e+00 3.1137e-01 1.6734e-04 -1.4347e-03 1.4275e-04 1.7573e-04 -6.0000e+00 2.4014e-02 3.2382e-03 1.3448e-05 12 8 8 10 0 0 76.67 22.11 0.26 0.00324 -0.00754 188 37 1 5 0 264.237 25.17 20.00 22.11 4.04 21.8 1019.88 -357797 -135922 -295657 -215120 -333350 -244830 -262756 -257564 900000 -238548 -136286 -269323 -85702 -84933 -24039 -69998 -121885 43501 -74252 900000 -111149 900000 -103797 11311 -98398 -80595 -108693 -50337 -55997 -38510 3238 -12102 11380 -15305 29475 -12934 1594 -13336 -9506 14016 -5152 38071 8229 38448 2357 18351 20522 15697 38698 11011 4348 15069 24597 10815 19898 7339 6949 17441 6139 13172 5759 10939 -3012 10065 3458 11682 6986 4159 7350 2563 5580 2449 5539 2839 2978 1313 5083 4190 2410 2144 -147 121 -3128 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