File name: Pandora30s1_Juelich_20201107_L2Fit_fout2c3d20191023p1-8.txt File generation date: 20251119T155633.3Z 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_20201107_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: 20201107 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 20201107T073827.8Z 7616.318378 281 1 47.64 2 82.64 127.70 44.76 248.56 0.00 1 0.00 1 0 17 6.071e-01 6.192e-02 1.786e-01 9.439e-03 7.535196e-01 5.261514e-03 9.360919e-03 -6.000000e+00 3.471881e-01 221.89 -2.00 3.80 -2.00 321.42 0.00e+00 2.324229e-03 2.080375e-03 3.059719e-03 -6.000000e+00 1.727515e-02 273.27 -2.00 20.00 -2.00 320.97 0.00e+00 7.228 0.008 302.00 328.00 3 2.1107e+00 1.6482e-02 8.3239e-02 -6.0000e+00 8.5263e-01 1.0829e+00 1.9910e-02 4.4321e-02 -6.0000e+00 9.3065e-01 -1.3986e+00 1.5643e-02 2.2905e-02 -6.0000e+00 5.5316e-01 5.7041e-01 8.0511e-03 7.1742e-03 -6.0000e+00 2.4452e-01 2.2783e-05 -1.3897e-03 2.6873e-04 1.1651e-04 -6.0000e+00 1.7973e-02 1.2118e-03 0.0000e+00 12 9 8 11 32 0 64.75 21.35 -0.00 0.00121 -0.00923 26 6 1 5 0 1831.900 26.62 20.00 21.35 12.90 34.7 1013.50 900000 75407 -22912 900000 900000 229089 -111961 42162 900000 -36736 -2438 -5841 900000 81769 41783 68996 51776 211686 900000 17902 165804 900000 900000 -20781 242320 900000 -18605 900000 -80389 900000 900000 100267 106112 54617 72572 81115 41321 900000 900000 51484 900000 84997 117605 158184 11973 111187 83459 900000 -4226 18198 47671 -21521 15422 136063 76068 54583 34449 45811 -47793 141505 155575 72525 17877 30788 4945 16083 2502 -27940 4402 16158 36037 27007 2862 660 -9753 62889 -21243 44228 49286 -26425 32771 4273 -5629 2024 11181 1546 25621 12961 11539 -13657 14357 11079 -652 8175 199 -4993 -4170 -337 -3529 -12761 -249 3566 -4989 -3217 -12743 -5559 -5278 -5671 450 3853 -2621 85 -6477 -2816 4442 -1592 -4267 -538 250 4523 9478 2574 3852 7563 5455 2990 -5994 3654 -4231 1963 2742 4206 1117 1783 -1775 -1253 872 1042 753 1043 -5497 -3283 900000 2594 -1982 900000 900000 2101 -13538 1303 900000 -2443 -111 -281 900000 2448 2108 3165 2850 2856 900000 1404 3126 900000 900000 -2068 2223 900000 -1758 900000 -11307 900000 900000 3679 4110 3454 3504 3329 2613 900000 900000 4549 900000 6032 6075 5643 1609 5744 5641 900000 -676 2446 5204 -4907 2737 8080 8520 7335 5672 6493 -15428 7644 7373 8158 3739 6326 1302 3851 675 -10081 1279 4757 9851 7845 1018 220 -3212 9807 -6561 7769 9494 -12385 10446 1964 -3103 1090 5836 896 12747 7428 6593 -9094 7037 5294 -346 4278 130 -3876 -3747 -333 -3697 -14373 -237 2894 -4104 -2698 -12683 -5433 -5482 -6158 520 4909 -3793 126 -10205 -4120 6009 -2240 -6364 -819 382 6715 13509 3750 5369 9845 7021 3796 -8327 5118 -7131 3516 5316 8181 2380 4046 -4276 -3095 2136 2558 1802 2425 -12630 -6933 SS 20201107T074528.3Z 7616.323244 285 1 48.55 2 81.78 129.15 45.78 250.24 0.00 1 0.00 1 0 17 5.978e-01 3.711e-02 1.914e-01 5.673e-03 7.003431e-01 3.031494e-03 8.991018e-03 -6.000000e+00 3.371151e-01 221.89 -2.00 3.80 -2.00 321.29 0.00e+00 9.459980e-03 1.279303e-03 3.496109e-03 -6.000000e+00 1.544848e-02 273.27 -2.00 20.00 -2.00 320.84 0.00e+00 6.567 0.006 302.00 328.00 3 2.0203e+00 9.6174e-03 7.5928e-02 -6.0000e+00 8.3268e-01 6.6233e-01 1.2068e-02 4.0492e-02 -6.0000e+00 9.0951e-01 -9.2218e-01 1.0719e-02 2.4810e-02 -6.0000e+00 5.3869e-01 3.9378e-01 5.3513e-03 1.1528e-02 -6.0000e+00 2.3184e-01 5.2865e-05 -1.7082e-03 1.5744e-04 1.7225e-04 -6.0000e+00 1.6405e-02 6.2906e-04 0.0000e+00 12 9 8 11 8 0 64.62 21.35 0.10 0.00063 -0.01221 47 11 1 5 0 1032.740 26.62 20.00 21.35 13.18 35.0 1013.63 206286 -27565 -97686 900000 900000 17660 -158741 -81989 900000 -112305 -95742 -85738 900000 -5539 -29218 34563 -25556 89046 900000 -28537 59258 210809 262199 -59136 76982 105752 -43026 106318 -89521 211512 95593 58742 34134 44171 20485 30381 10955 96948 133147 31662 202849 32944 68693 66964 12932 65917 35221 94275 2071 35041 92678 436 9916 50323 43688 26295 23686 17442 -24506 36652 48271 31272 8875 21505 3894 13374 3666 -13242 1825 8040 16134 9093 3615 -4572 -4461 18470 -14741 10200 16654 -15569 10057 153 -6075 -1173 878 -2449 6560 1375 3271 -6254 6737 3007 -2324 1019 -2146 -4142 -2972 -756 -1805 -4066 -6039 330 3241 -3656 -6045 -5408 -2534 -3519 319 1371 -851 -191 -3257 -489 1195 -155 -2415 1044 652 2518 4425 2407 3166 3702 3166 1281 -1458 698 -1055 1675 1426 2694 -161 868 -1342 -414 730 194 830 -109 -2627 -3069 1140 -770 -5452 900000 900000 244 -11053 -2861 900000 -5520 -3898 -3341 900000 -163 -1300 1019 -1442 1804 900000 -1876 1674 1302 1449 -4764 1802 1856 -2928 1728 -8956 1315 2113 2128 1813 2237 1226 1548 710 3214 3636 2605 3495 2922 4661 4687 1474 4735 3309 5325 289 3720 6402 79 1774 6411 6162 4489 4168 3181 -6168 5138 6219 5293 2150 5172 1112 3374 1001 -4420 582 2761 5545 3439 1399 -1780 -1558 4813 -4806 2842 5023 -7399 4335 83 -3619 -702 548 -1678 4304 970 2238 -4488 3950 1718 -1370 621 -1557 -3608 -2851 -812 -2014 -4555 -6621 301 2806 -3356 -6138 -5758 -2790 -4245 397 1920 -1290 -300 -5247 -735 1748 -225 -3693 1633 1041 4017 7020 3725 4709 5300 4405 1745 -2034 1050 -1786 3107 2764 5448 -355 1944 -3275 -1033 1826 490 2038 -254 -6077 -6720 SS 20201107T075627.6Z 7616.330875 288 1 49.15 2 80.46 131.46 47.39 252.79 0.00 1 0.00 1 0 25 4.639e-01 1.848e-02 2.069e-01 3.113e-03 6.297997e-01 1.620273e-03 7.828796e-03 -6.000000e+00 2.592599e-01 221.89 -2.00 3.80 -2.00 320.92 0.00e+00 6.309172e-03 6.613370e-04 1.223119e-03 -6.000000e+00 1.120478e-02 273.27 -2.00 20.00 -2.00 320.46 0.00e+00 5.754 0.004 302.00 328.00 3 1.9392e+00 5.0111e-03 6.6417e-02 -6.0000e+00 6.3804e-01 1.8973e-01 6.5418e-03 3.5822e-02 -6.0000e+00 6.9543e-01 -2.8010e-01 6.6373e-03 2.1002e-02 -6.0000e+00 4.1378e-01 1.2053e-01 3.3013e-03 9.7665e-03 -6.0000e+00 1.7837e-01 1.4330e-04 -9.2790e-04 8.5928e-05 1.0871e-04 -6.0000e+00 1.2226e-02 7.3804e-04 0.0000e+00 12 8 8 10 0 0 60.41 21.35 0.12 0.00074 -0.00623 88 21 1 5 0 552.110 26.62 20.00 21.35 13.36 34.9 1013.66 46460 -140509 -162494 38634 61914 -78426 -208732 -118885 78059 -125309 -139199 -124848 182270 -32694 -66811 -29185 -37107 -5924 202731 -60208 21645 44788 61546 -49863 28001 23844 -50672 19540 -81816 41690 24140 22839 13780 3930 -656 -3876 8382 22976 35237 5648 41515 10536 13749 21258 -2470 19047 8852 23953 -1403 8368 26309 -2803 4797 16212 12714 6211 5260 4691 -13785 11252 14333 12509 3441 6975 -541 2858 521 -6126 282 1456 5007 1526 -280 -2244 -2101 4879 -7203 3362 4645 -5737 2128 -1776 -3480 -1682 -138 -1365 2678 305 1854 -2699 1700 1154 -1109 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