File name: Pandora132s1_Berlin_20220916_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T181636.0Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Thomas Ruhtz Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 132 Spectrometer number: 1 Processing software version used: BlickP v1.8.60 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20220916_L1_smca1c13d20210422p1-8.txt Full location name: Institute of Space Sciences FU Berlin Short location name: Berlin Country of location: Germany Location latitude [deg]: 52.4600 Location longitude [deg]: 13.3100 Location altitude [m]: 100 Local noon date: 20220916 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: Modification of session 11, but different RefDay (April 2021). First and last pixel inside fitting window: 243 385 Nominal wavelengths inside fitting window [nm]: 305.1071 305.2480 305.3889 305.5298 305.6707 305.8116 305.9524 306.0932 306.2341 306.3749 306.5157 306.6565 306.7973 306.9380 307.0788 307.2195 307.3603 307.5010 307.6417 307.7824 307.9231 308.0638 308.2044 308.3451 308.4857 308.6264 308.7670 308.9076 309.0482 309.1888 309.3293 309.4699 309.6104 309.7510 309.8915 310.0320 310.1725 310.3130 310.4534 310.5939 310.7344 310.8748 311.0152 311.1556 311.2960 311.4364 311.5768 311.7172 311.8575 311.9979 312.1382 312.2785 312.4188 312.5591 312.6994 312.8397 312.9800 313.1202 313.2604 313.4007 313.5409 313.6811 313.8213 313.9615 314.1016 314.2418 314.3819 314.5221 314.6622 314.8023 314.9424 315.0825 315.2225 315.3626 315.5026 315.6427 315.7827 315.9227 316.0627 316.2027 316.3427 316.4827 316.6226 316.7626 316.9025 317.0424 317.1823 317.3222 317.4621 317.6020 317.7418 317.8817 318.0215 318.1613 318.3012 318.4410 318.5807 318.7205 318.8603 319.0000 319.1398 319.2795 319.4192 319.5589 319.6986 319.8383 319.9780 320.1177 320.2573 320.3969 320.5366 320.6762 320.8158 320.9554 321.0949 321.2345 321.3741 321.5136 321.6531 321.7927 321.9322 322.0717 322.2111 322.3506 322.4901 322.6295 322.7689 322.9084 323.0478 323.1872 323.3266 323.4659 323.6053 323.7447 323.8840 324.0233 324.1627 324.3020 324.4413 324.5805 324.7198 324.8591 324.9983 --------------------------------------------------------------------------------------- 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: 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: Temperature at electronics board 1 [°C], 999=no temperature signal Column 98: Temperature at electronics board 2 [°C], 999=no temperature signal Column 99: Humidity in head sensor [%], -9=no humidity signal Column 100: Pressure in head sensor [hPa], -9=no pressure signal Columns 101-243: Unweighted slant column residuals for each pixel inside the fitting window multiplied by 1e5, 9e5=pixel was not used for fitting Columns 244-386: 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 20220916T054738.2Z 8294.241414 206 1 1.98 2 80.94 97.54 39.32 232.99 0.00 1 0.00 1 0 25 4.966e-01 3.745e-02 4.022e-01 3.296e-02 7.548869e-01 1.874345e-02 1.100816e-02 -6.000000e+00 2.954233e-01 228.59 -2.00 3.85 -2.00 321.36 0.00e+00 -4.617402e-03 8.997984e-03 1.281876e-02 -6.000000e+00 1.602246e-02 279.56 -2.00 20.00 -2.00 320.82 0.00e+00 6.019 0.005 302.00 328.00 3 1.8123e+00 6.2784e-02 1.0084e-01 -6.0000e+00 7.4078e-01 4.6880e-01 8.3541e-02 1.0463e-01 -6.0000e+00 8.1323e-01 -7.0059e-01 7.5372e-02 3.8208e-02 -6.0000e+00 4.7569e-01 3.1032e-01 3.5643e-02 7.4037e-03 -6.0000e+00 1.9867e-01 1.0763e-04 4.7778e-04 9.4498e-04 1.6279e-04 -6.0000e+00 1.4382e-02 -9.2241e-03 0.0000e+00 12 9 9 12 1 1 999.00 16.39 0.31 -0.00922 -0.00563 1 12 2 8 0 904.780 15.00 16.39 18.56 20.77 21.17 26.0 972.08 -163971 900000 900000 900000 -193513 900000 900000 -100321 900000 -194531 900000 -121100 -32131 -89136 900000 -42097 44886 900000 900000 900000 -77962 900000 14378 900000 -84481 900000 130742 -55580 900000 -74964 900000 -27972 900000 123156 48277 -4323 -35076 33161 17361 900000 12995 77910 19402 182536 30927 -589 39672 42884 175396 9490 15944 26922 18572 4834 20787 47243 21960 63588 23581 13525 17005 20798 6899 43816 26468 -15 13596 20093 28560 -7868 15344 6190 8632 6242 -4634 15626 -10655 9932 -2583 -1839 -2870 8205 -7163 -7056 -1790 -4311 13673 -6257 6311 -2560 -600 -7085 -5200 -2649 -12819 2261 -3605 -149 -5871 -4617 -2926 3401 -1821 -5184 -879 -4179 2799 -3136 3515 1632 2706 -612 1602 774 -4415 2262 958 2215 2387 1904 457 2889 2605 -3583 391 -8 3204 406 795 1669 -37 33 -1212 482 -1208 -197 -632 1338 1003 308 738 -2542 -2012 -5251 900000 900000 900000 -7230 900000 900000 -3213 900000 -10902 900000 -3878 -1029 -3092 900000 -1348 1437 900000 900000 900000 -3953 900000 460 900000 -5862 900000 4187 -2912 900000 -5019 900000 -1629 900000 3944 1546 -214 -2655 1545 1162 900000 1173 3856 1751 5845 2431 -63 2887 3121 5617 1105 1949 3292 2478 800 3107 6189 3458 7034 3398 2093 2632 3441 1491 7249 5368 -4 3084 4558 6783 -3065 5118 2313 3041 2082 -1546 3836 -3270 2624 -896 -756 -1287 3739 -4147 -4346 -1116 -2920 8083 -4578 3996 -1684 -362 -4328 -3100 -1664 -10262 1821 -3315 -150 -6674 -5090 -2911 3058 -1624 -4589 -800 -4158 2760 -3558 4188 2097 3801 -933 2387 1123 -6428 3008 1321 3177 3603 2935 695 4095 3570 -5063 549 -10 4177 591 1235 2908 -68 63 -2507 1050 -2682 -449 -1474 3069 2263 662 1559 -5195 -4050 SS 20220916T055838.1Z 8294.249052 211 1 49.64 2 79.28 99.77 40.64 236.26 0.00 1 0.00 1 0 17 5.879e-01 4.259e-02 3.343e-01 2.338e-02 6.327461e-01 1.305021e-02 8.073219e-03 -6.000000e+00 3.443327e-01 228.58 -2.00 3.85 -2.00 321.36 0.00e+00 7.330338e-03 5.714000e-03 2.620542e-03 -6.000000e+00 1.718356e-02 279.56 -2.00 20.00 -2.00 320.80 0.00e+00 5.174 0.003 302.00 328.00 3 3.7395e+00 4.2817e-02 6.3095e-02 -6.0000e+00 8.6202e-01 5.3314e-01 5.2655e-02 3.7117e-02 -6.0000e+00 9.4185e-01 -8.0226e-01 4.1563e-02 1.9598e-02 -6.0000e+00 5.5495e-01 3.6438e-01 2.0446e-02 7.2831e-03 -6.0000e+00 2.3270e-01 3.7006e-05 -2.2666e-03 7.1445e-04 1.2006e-04 -6.0000e+00 1.6884e-02 -2.1115e-03 0.0000e+00 12 8 8 10 0 0 99.99 16.39 0.48 -0.00211 -0.01914 64 14 2 8 0 775.490 15.00 16.39 18.73 20.77 21.17 26.1 973.71 -120109 900000 -43648 900000 155819 -66408 900000 -76368 900000 -123956 900000 -73095 900000 48808 48891 900000 -76112 900000 -18117 95454 -29962 900000 900000 125001 900000 -25457 317529 -68464 900000 -31566 900000 23251 33399 120040 -91 189033 -20521 263557 18673 154271 39094 38709 41282 24782 123706 -4451 97861 7292 106717 8171 72636 19022 15740 40224 1255 56188 3248 57068 2846 37476 30424 17976 33251 20165 29851 -5836 20091 -4736 13261 12655 7462 14333 -7643 12809 -14606 16812 -7171 15262 -54 -4793 5073 -7566 10657 -11180 1731 -5703 3956 -4487 3794 4695 -6521 6492 -10620 6564 -11333 1496 -6857 -527 -50 -4006 553 -6355 5640 -5638 2239 -7603 -1083 -2637 -2208 1734 -2622 4610 -3889 692 -1694 2661 -1158 236 2496 -2433 4319 -874 5929 895 3780 2677 1154 3315 1115 1849 -1179 3774 -1923 2100 -738 -303 1088 -1595 1311 -1949 2190 -3576 -1815 -8650 900000 -1572 900000 3544 -2334 900000 -3158 900000 -7753 900000 -3325 900000 1110 1213 900000 -8026 900000 -1161 2171 -2106 900000 900000 2843 900000 -1684 7222 -6370 900000 -2154 900000 1250 1795 2730 -6 4299 -1867 5994 1583 4210 3314 3441 3670 2613 5346 -635 5058 950 5825 1149 5857 2871 2636 5572 265 6970 685 6844 565 5192 4718 3494 6256 4753 6542 -1762 4569 -1430 3729 4056 2715 4979 -3208 4079 -5527 4171 -2135 3755 -18 -1942 2161 -4114 5222 -7212 1045 -3938 2601 -3275 2518 2951 -4274 3490 -6565 3597 -8412 1136 -6536 -534 -54 -4439 541 -5979 4420 -5094 2010 -7970 -1126 -2993 -2762 2334 -3698 6872 -5735 1017 -2413 3521 -1624 343 3772 -3979 6510 -1333 8152 1250 4939 3393 1455 4360 1692 3119 -2221 7125 -4036 4499 -1728 -734 2652 -4023 3170 -4646 4682 -7608 -3730 SS 20220916T060425.6Z 8294.253074 214 1 50.00 2 78.42 100.95 41.35 237.93 0.00 1 0.00 1 0 17 4.371e-01 3.576e-02 3.734e-01 3.166e-02 6.010827e-01 1.711828e-02 7.379095e-03 -6.000000e+00 2.542751e-01 228.58 -2.00 3.85 -2.00 320.99 0.00e+00 3.989210e-03 6.807466e-03 1.658094e-03 -6.000000e+00 1.337242e-02 279.56 -2.00 20.00 -2.00 320.38 0.00e+00 4.818 0.002 302.00 328.00 3 4.5804e+00 5.4139e-02 5.8693e-02 -6.0000e+00 6.3897e-01 3.6072e-01 6.6653e-02 3.4558e-02 -6.0000e+00 6.9888e-01 -3.8859e-01 5.6535e-02 1.7797e-02 -6.0000e+00 4.1075e-01 1.6981e-01 2.8131e-02 5.8015e-03 -6.0000e+00 1.7347e-01 2.2595e-05 -1.6431e-03 9.4454e-04 8.2140e-05 -6.0000e+00 1.2512e-02 -7.2005e-03 0.0000e+00 12 8 8 10 0 0 99.97 16.40 0.68 -0.00720 -0.01955 31 7 1 8 0 1612.570 15.00 16.40 18.89 20.77 21.17 26.2 974.38 900000 -144695 2195 900000 -166685 -89327 124636 900000 -113156 900000 900000 900000 900000 -2257 -14575 -24631 900000 -43989 900000 -25246 23780 -8915 -24469 -108 -7197 22045 -86922 -53330 -33154 278659 -5050 -19154 -11398 -37056 123906 -31877 148465 -1356 69460 12159 29384 29463 -9500 60977 -7634 44123 -11933 26842 -24088 21283 7712 29309 59095 -7085 28345 4449 25470 -3689 2849 20660 4857 20780 -4981 13005 5911 2171 11915 6597 -822 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