File name: Pandora132s1_Berlin_20220905_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T181316.4Z 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_20220905_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: 20220905 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 20220905T051011.9Z 8283.215416 48 1 49.09 2 83.90 86.75 152.12 326.85 0.00 1 0.00 1 0 33 6.417e-01 7.719e-02 4.778e-01 6.525e-02 8.220340e-01 3.798444e-02 9.499669e-03 -6.000000e+00 3.851150e-01 229.97 -2.00 3.85 -2.00 321.79 0.00e+00 -8.026240e-03 1.508355e-02 3.726585e-03 -6.000000e+00 2.106708e-02 280.71 -2.00 20.00 -2.00 321.18 0.00e+00 8.424 0.013 302.00 328.00 3 1.8833e+00 1.2671e-01 9.9025e-02 -6.0000e+00 9.7146e-01 1.4636e+00 1.5121e-01 5.9840e-02 -6.0000e+00 1.0683e+00 -1.6950e+00 9.5405e-02 2.3311e-02 -6.0000e+00 6.2110e-01 6.4972e-01 4.9574e-02 9.0352e-03 -6.0000e+00 2.5487e-01 8.0871e-06 2.3395e-03 1.8811e-03 8.2098e-05 -6.0000e+00 1.8906e-02 1.1622e-03 0.0000e+00 12 8 8 10 0 0 44.38 16.92 1.07 0.00116 0.01874 15 3 4 8 0 3272.370 15.00 16.92 21.65 21.17 21.69 26.5 982.86 170632 167787 87030 900000 -1390 900000 -69830 900000 -8264 900000 900000 -72773 900000 -18910 900000 -36890 900000 66222 900000 277772 -29638 45393 -71458 900000 -15719 900000 -44305 900000 106171 180659 153242 -20243 900000 -62138 900000 900000 163455 -39165 197350 900000 6138 67705 -28669 900000 -7528 50139 15851 11397 900000 -1687 36466 63074 120862 2641 170590 15528 21711 81776 -2258 49526 -33831 275038 -18172 80087 86 71656 66995 -16462 12305 28457 42083 -3303 38930 20383 10465 40229 -399 62865 -484 31331 -17668 15720 -3757 39889 -14605 19450 -4285 -2010 10324 3033 20462 9724 20741 5715 -162 -10865 -16463 2942 -15248 7041 -16686 10727 -8632 -7335 3567 -5864 13256 -558 8042 -8998 7001 -11624 5376 2531 1287 11697 5802 2049 -5053 8773 -7271 5316 -2670 -5910 8630 1695 9690 -3678 4405 -2238 529 4480 2389 -3727 2654 1692 -6023 4167 380 806 -4214 798 -415 10818 10638 5518 900000 -88 900000 -7379 900000 -524 900000 900000 -9228 900000 -1962 900000 -4873 900000 4199 900000 17611 -3416 2878 -12356 900000 -1721 900000 -5618 900000 6731 11454 9716 -2217 900000 -10386 900000 900000 10363 -6095 12512 900000 849 5073 -5453 900000 -1041 3757 1645 1248 900000 -233 3783 5453 7663 472 10816 2595 3379 7259 -390 5338 -7800 17438 -4399 8632 19 8178 8070 -4460 2837 6233 9338 -1047 8392 4782 2389 6121 -88 7971 -135 7548 -7332 5255 -1646 13151 -7997 7960 -2297 -1054 4641 1381 8043 4069 7890 2536 -89 -7765 -14423 2391 -15644 5600 -15291 6677 -6219 -5454 2549 -4867 9704 -515 7741 -11721 8594 -18022 7034 3296 1632 13214 7190 2788 -7748 11782 -11064 6802 -3585 -7972 9749 1983 10611 -5130 6575 -4050 1018 8856 5163 -9216 6561 4369 -17046 10665 984 1952 -9909 1679 -888 SS 20220905T051614.3Z 8283.219610 51 1 48.85 2 82.98 87.94 152.58 329.40 0.00 1 0.00 1 0 25 5.548e-01 3.583e-02 4.430e-01 3.158e-02 7.669853e-01 1.767261e-02 9.911851e-03 -6.000000e+00 3.294210e-01 229.97 -2.00 3.85 -2.00 322.04 0.00e+00 1.030659e-02 9.210366e-03 6.557245e-03 -6.000000e+00 1.606744e-02 280.71 -2.00 20.00 -2.00 321.49 0.00e+00 7.510 0.009 302.00 328.00 3 1.9394e+00 6.5605e-02 8.9833e-02 -6.0000e+00 8.3164e-01 1.0271e+00 7.9351e-02 4.9638e-02 -6.0000e+00 9.1156e-01 -1.4097e+00 5.7751e-02 2.5587e-02 -6.0000e+00 5.2922e-01 5.7625e-01 2.8416e-02 9.6982e-03 -6.0000e+00 2.1818e-01 2.1541e-05 -3.9494e-05 9.2087e-04 2.5005e-04 -6.0000e+00 1.5816e-02 1.0975e-03 0.0000e+00 12 8 8 10 0 0 -12.42 16.92 0.95 0.00110 0.00080 30 6 4 8 0 1628.160 15.01 16.92 21.94 21.17 21.69 26.4 983.77 900000 -90061 115446 -61268 12091 900000 -24531 900000 900000 900000 -115390 50248 900000 -48017 17365 900000 129753 115139 900000 34847 900000 -69865 163715 78291 900000 47825 5018 60827 -74195 -55621 -37524 35587 -17795 166970 900000 62856 231166 94934 80609 -13129 137364 -20586 60607 -603 30716 27089 -16184 82023 4069 294022 46778 48015 47662 42827 47987 55167 22459 20657 66815 21873 88269 14034 18718 20873 14423 15022 212 25450 -22 19505 5022 18572 34526 3619 18791 -909 39444 -9469 7926 -4301 -3336 12960 -6749 8021 -2053 3508 1153 -3667 -10777 -1356 3 -8539 -2297 -8021 4897 -6359 -6107 -4811 -157 2912 -4499 -4263 405 2315 -3777 679 -3578 -3618 -3986 1853 451 -1874 416 -3933 853 -2972 -711 1035 2480 1858 1957 3196 2233 3362 1783 925 -871 2917 24 1543 2746 -2470 1795 -2186 2518 -958 -357 262 833 1145 -1241 -2538 -579 900000 -7612 3548 -3424 372 900000 -754 900000 900000 900000 -7415 1544 900000 -2817 631 900000 3988 3539 900000 1266 900000 -6247 5032 2406 900000 1470 182 1870 -5597 -3885 -2621 1531 -1293 5132 900000 1932 7105 2918 2973 -1247 4222 -2301 3353 -61 2266 2081 -1940 3781 425 9037 3738 4132 4395 4344 4720 5087 2830 2540 4929 2487 5426 2027 2934 3528 2660 2678 44 4302 -5 4436 1405 4566 6897 901 3581 -190 5334 -2241 1851 -1362 -1220 4541 -3112 3378 -1016 1736 610 -2063 -6393 -696 2 -4173 -1052 -4240 2649 -4554 -4641 -4114 -137 2416 -3683 -3419 292 1700 -3170 578 -3398 -3417 -4277 2139 584 -2613 568 -5418 1075 -3837 -927 1409 3520 2700 2767 4269 3205 4640 2422 1225 -1178 4177 41 2677 5156 -5210 3868 -5258 6164 -2521 -951 697 2165 2808 -3186 -6193 -1377 SS 20220905T052920.4Z 8283.228708 54 1 49.52 2 80.99 90.54 153.46 335.14 0.00 1 0.00 1 0 17 5.328e-01 2.069e-02 3.497e-01 1.269e-02 6.758852e-01 7.065610e-03 8.732737e-03 -6.000000e+00 3.084958e-01 229.97 -2.00 3.85 -2.00 321.78 0.00e+00 8.949515e-03 3.759947e-03 4.849244e-03 -6.000000e+00 1.394346e-02 280.71 -2.00 20.00 -2.00 321.24 0.00e+00 6.050 0.005 302.00 328.00 3 2.3180e+00 2.5704e-02 7.3950e-02 -6.0000e+00 7.6972e-01 2.9745e-01 3.4965e-02 4.5605e-02 -6.0000e+00 8.3788e-01 -4.4179e-01 3.3305e-02 2.6496e-02 -6.0000e+00 4.9602e-01 1.8389e-01 1.5530e-02 1.0123e-02 -6.0000e+00 2.0915e-01 6.9854e-05 -7.7998e-04 3.8089e-04 1.7642e-04 -6.0000e+00 1.4706e-02 1.5666e-03 0.0000e+00 12 8 8 10 0 0 24.23 16.92 0.33 0.00157 -0.00429 56 12 4 8 0 884.130 15.01 16.92 22.28 21.17 21.69 26.5 985.79 900000 900000 -137900 -137145 -193264 900000 -214836 -49283 -138584 120524 -179304 -140933 -25240 -156281 57888 -108319 136315 -58264 21526 -6152 -44980 13911 -75348 900000 -59502 81016 -68801 16127 -70987 -51898 8729 -31909 200150 -23063 31094 -32765 52699 -22097 50025 38970 2221 51624 -6224 67016 -4319 63764 8966 33204 29607 -10024 37288 -1406 31025 13767 37231 9383 8588 9997 13354 23925 358 30877 10781 16169 7718 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