File name: Pandora132s1_Berlin_20231015_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T204900.4Z 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_20231015_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: 20231015 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 20231015T061503.9Z 8688.260462 66 1 50.00 2 84.51 111.53 90.47 108.53 0.00 1 0.00 1 0 25 6.096e-01 5.381e-02 4.970e-01 4.673e-02 1.100126e+00 2.816193e-02 1.300207e-02 -6.000000e+00 3.574203e-01 224.36 -2.00 3.85 -2.00 322.36 0.00e+00 -8.962853e-03 1.258018e-02 2.773033e-03 -6.000000e+00 1.626589e-02 275.52 -2.00 20.00 -2.00 321.88 0.00e+00 9.160 0.017 302.00 328.00 3 2.8311e-01 9.8612e-02 1.1247e-01 -6.0000e+00 8.8543e-01 2.1146e+00 1.1872e-01 6.9672e-02 -6.0000e+00 9.7320e-01 -2.2609e+00 8.2258e-02 3.2602e-02 -6.0000e+00 5.7321e-01 7.9491e-01 4.3695e-02 1.1455e-02 -6.0000e+00 2.4240e-01 1.2994e-05 -2.2195e-03 1.2167e-03 1.3810e-04 -6.0000e+00 1.8680e-02 -2.7752e-04 0.0000e+00 12 9 9 12 4 4 -8.99 5.32 0.67 -0.00028 -0.01696 37 8 4 8 0 1351.090 15.00 5.32 14.31 22.80 23.22 28.2 942.49 900000 280307 -8108 179008 -44466 900000 23656 900000 -86599 31500 87284 -48588 900000 900000 900000 -50129 900000 -10500 54600 900000 36292 188565 -35098 900000 -47361 267152 8001 900000 39415 -8367 49099 23474 119084 28722 900000 -34799 900000 900000 14139 900000 22546 900000 251 900000 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6386 -5737 4033 2797 2756 3249 -7864 8180 -6549 10237 6075 3828 2273 -2853 2492 -770 -42 -7300 1139 -5217 -3915 -2546 -717 3941 826 6721 -6829 -6634 -596 487 2766 -6204 6408 -3945 6913 -3097 7047 -1798 2981 -1422 -3978 -1982 -2252 10899 -6854 10482 -5394 1736 -2851 2890 -1647 459 9741 -3490 6565 -3569 -453 -15905 -2375 12343 -2246 1865 -2211 4025 -183 5756 -2922 -366 -3510 SS 20231015T062108.2Z 8688.264679 69 1 49.89 2 83.65 112.77 89.65 109.72 0.00 1 0.00 1 0 17 5.178e-01 2.566e-02 4.943e-01 2.371e-02 1.002415e+00 1.377199e-02 1.120690e-02 -6.000000e+00 2.946616e-01 224.36 -2.00 3.85 -2.00 322.47 0.00e+00 -1.164723e-02 7.655400e-03 4.005140e-03 -6.000000e+00 1.297524e-02 275.52 -2.00 20.00 -2.00 322.03 0.00e+00 8.168 0.012 302.00 328.00 3 6.9299e-01 5.2968e-02 1.0348e-01 -6.0000e+00 7.2801e-01 1.2190e+00 7.0045e-02 7.1129e-02 -6.0000e+00 7.9628e-01 -1.6220e+00 6.0827e-02 3.3473e-02 -6.0000e+00 4.7228e-01 6.3443e-01 2.8916e-02 1.0921e-02 -6.0000e+00 1.9813e-01 3.3687e-05 2.3904e-04 6.3138e-04 1.3464e-04 -6.0000e+00 1.4332e-02 -1.3593e-03 0.0000e+00 12 9 9 12 4 4 33.01 5.33 0.53 -0.00136 0.00044 64 14 4 8 0 779.410 15.00 5.33 14.77 22.80 23.22 28.0 943.84 -72275 -61729 -87881 -96042 127865 900000 -85398 -117650 15638 -164007 22900 -104410 900000 -58035 81512 900000 39897 29190 -58365 71331 -78567 61640 50244 -7181 87819 40563 -43060 -85351 900000 69558 900000 -40988 -21650 132711 -14155 82098 687 151853 -29624 256306 63079 156993 34467 -11361 46503 21598 -8143 47996 22628 19504 53811 38650 44036 68052 23958 66435 -4141 58386 3283 95423 27378 31649 29262 48469 44899 -12523 5935 6900 37144 17729 25625 5016 9439 27276 -9502 13152 8192 -924 12445 -1816 1951 7956 8420 843 9572 701 10326 -1013 833 4299 -1143 1014 -5252 -2672 -6263 -2015 -9425 -342 -2355 144 -3690 -7332 -5196 -1300 -1165 -2582 624 -5775 -750 993 -1375 -1487 -1993 393 -1515 608 -1066 -157 2262 422 2934 439 2973 1065 2405 1996 2242 1581 -306 1490 -1258 823 -1170 1471 -432 358 506 64 531 95 -922 -1972 -814 -1670 -1426 -2215 -2219 2954 900000 -1973 -3460 361 -8612 529 -3509 900000 -1707 1883 900000 922 674 -2329 1648 -3465 1424 1161 -181 2029 937 -1538 -4123 900000 1607 900000 -1808 -950 3066 -523 1897 24 3508 -2053 5922 2186 3627 1593 -787 1719 998 -508 1774 1150 1127 2486 2322 2747 3616 2103 3991 -507 3642 326 3527 2024 2486 2704 4143 4149 -2054 836 1052 4806 3154 4499 1089 1854 4033 -1778 1762 1136 -154 2157 -441 541 2390 2762 317 3494 293 4056 -447 350 1649 -436 368 -2099 -1173 -3386 -1134 -6731 -256 -1929 113 -2744 -4974 -3197 -789 -756 -1800 452 -4949 -709 1080 -1741 -2030 -2801 532 -2027 786 -1444 -222 3260 617 3994 578 3677 1313 2848 2305 2623 2098 -492 2738 -2655 1847 -2901 3847 -1232 1048 1498 190 1528 256 -2293 -4590 -1860 SS 20231015T063356.9Z 8688.273575 72 1 49.73 2 81.87 115.42 87.92 112.24 0.00 1 0.00 1 0 17 6.673e-01 1.541e-02 3.163e-01 7.004e-03 8.608660e-01 3.967522e-03 9.978662e-03 -6.000000e+00 3.768429e-01 224.36 -2.00 3.85 -2.00 322.19 0.00e+00 5.901958e-03 2.266141e-03 1.561935e-03 -6.000000e+00 1.703929e-02 275.52 -2.00 20.00 -2.00 321.74 0.00e+00 6.630 0.006 302.00 328.00 3 5.6882e-01 1.4886e-02 8.3088e-02 -6.0000e+00 9.3200e-01 4.0630e-01 2.2775e-02 5.4190e-02 -6.0000e+00 1.0198e+00 -5.6541e-01 2.4956e-02 2.9311e-02 -6.0000e+00 6.0607e-01 2.3381e-01 1.1329e-02 1.1881e-02 -6.0000e+00 2.5609e-01 1.9360e-04 -7.0185e-04 1.9555e-04 1.6164e-04 -6.0000e+00 1.8330e-02 -1.2015e-03 0.0000e+00 12 9 9 12 4 4 92.41 5.37 0.27 -0.00120 -0.00648 187 40 4 8 0 264.490 15.01 5.37 15.30 22.80 23.22 28.0 946.11 900000 -266864 -106336 -216061 -210095 -171307 -281968 -14901 -266904 -93023 -267538 900000 -191009 18018 -112602 -157690 -63364 -115771 900000 -95690 -71359 -51270 -19707 -26164 -67060 23318 -105590 -13011 -111164 -38079 -51582 -23958 -45623 -18983 3247 -19962 -8602 -29153 8458 -3369 -6676 10305 16461 13043 -1020 50415 24448 29276 6325 20621 29642 22378 20602 6480 28004 12207 18548 3441 29227 4129 16980 17096 15966 18963 6470 18822 4491 10082 9051 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