File name: Pandora132s1_Berlin_20230328_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T192524.8Z 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_20230328_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: 20230328 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 20230328T054350.4Z 8487.238778 126 1 8.64 2 82.86 94.56 99.38 15.49 0.00 1 0.00 1 0 23 6.307e-01 5.802e-02 5.004e-01 4.826e-02 1.239930e+00 2.860988e-02 1.464072e-02 -6.000000e+00 3.723181e-01 226.11 -2.00 3.85 -2.00 322.26 0.00e+00 -3.935874e-02 1.069810e-02 1.148079e-02 -6.000000e+00 1.734982e-02 270.02 -2.00 20.00 -2.00 321.80 0.00e+00 7.415 0.009 302.00 328.00 3 1.5413e+00 9.5822e-02 1.4199e-01 -6.0000e+00 9.2913e-01 2.0696e+00 1.1618e-01 1.6595e-01 -6.0000e+00 1.0211e+00 -2.6317e+00 7.6878e-02 4.6301e-02 -6.0000e+00 5.9874e-01 1.0247e+00 4.2669e-02 2.8887e-02 -6.0000e+00 2.5031e-01 1.8634e-05 -5.2618e-08 1.1764e-03 2.5688e-04 -6.0000e+00 1.8062e-02 -2.2567e-02 0.0000e+00 12 9 9 12 1 1 99.10 17.06 0.62 -0.02257 -0.02257 4 6 4 8 0 1693.150 15.00 17.06 7.28 21.69 22.09 26.0 968.34 900000 -906 900000 -22826 -17209 900000 156112 37936 37313 900000 -47566 200629 -71589 900000 171865 241400 900000 -7071 900000 -10775 900000 -32527 900000 16972 900000 97856 -18626 278336 49294 900000 4755 900000 6619 900000 152990 -32142 575 -9831 900000 43357 174842 21306 85798 22220 66478 124836 -19883 900000 45068 224623 16835 97450 27108 52717 8017 -3297 900000 5378 70762 -71912 48034 122217 57877 31004 -15858 46258 13265 76607 7439 56911 32289 25247 65959 6475 30001 -34626 42778 16825 102082 -22658 27075 31957 20832 14865 -7270 27573 -7251 13126 -18740 17591 8194 -7586 1568 -10118 15447 -2325 8783 -8827 1283 -5642 -7930 478 -19016 5249 -12356 8362 -8809 5984 -6056 -77 853 -4598 8459 -9630 1630 -2464 3837 2993 2216 1629 -3616 8091 3701 6938 -1515 7838 -1625 2227 915 -1925 2738 -6036 3940 -2901 1064 -1374 510 3656 387 1768 -2644 -1258 -3092 900000 -89 900000 -1785 -1009 900000 7324 1942 2228 900000 -6695 9412 -12595 900000 8063 11325 900000 -663 900000 -873 900000 -2775 900000 1231 900000 4591 -1986 13058 2313 900000 264 900000 423 900000 7177 -2468 34 -797 900000 3144 8203 2090 4025 1706 3119 5857 -1696 900000 2326 10538 1422 4572 2544 4204 992 -492 900000 711 4648 -15335 3155 5734 4073 3200 -2502 4340 1805 6110 1361 7209 5605 4738 7736 1215 3800 -7310 4014 2210 6705 -5701 5462 7196 5331 4311 -2760 7644 -2907 4255 -7993 4877 2342 -2491 495 -4100 5798 -1249 4982 -6890 985 -4620 -6088 293 -12733 2754 -8221 4779 -6387 4160 -5579 -80 1030 -5968 11076 -13968 2260 -3500 5204 4264 3290 2404 -5274 9697 4420 7842 -1816 8291 -1899 2821 1420 -3356 5203 -13828 8935 -7689 2911 -3997 1462 10064 1060 4411 -6161 -2606 -6322 SS 20230328T060825.8Z 8487.255854 135 1 5.50 2 79.14 99.51 98.25 20.67 0.00 1 0.00 1 0 17 5.782e-01 2.600e-02 3.649e-01 1.513e-02 9.092711e-01 8.519397e-03 1.060576e-02 -6.000000e+00 3.397438e-01 226.11 -2.00 3.85 -2.00 321.76 0.00e+00 9.614952e-03 4.082732e-03 2.141671e-03 -6.000000e+00 1.567817e-02 270.02 -2.00 20.00 -2.00 321.34 0.00e+00 5.114 0.003 302.00 328.00 3 1.1806e+00 2.8046e-02 7.6023e-02 -6.0000e+00 8.4968e-01 6.0131e-01 3.9469e-02 6.1742e-02 -6.0000e+00 9.3380e-01 -8.6722e-01 4.1861e-02 2.8557e-02 -6.0000e+00 5.4546e-01 3.7324e-01 1.9836e-02 1.4811e-02 -6.0000e+00 2.2352e-01 3.6451e-04 -7.5922e-04 3.9314e-04 1.5664e-04 -6.0000e+00 1.6335e-02 -2.2402e-02 0.0000e+00 12 9 9 12 1 1 99.33 17.10 0.17 -0.02240 -0.02811 6 14 3 8 0 759.770 15.02 17.10 8.05 21.69 22.09 26.1 971.82 -59767 -225402 900000 -120105 -195861 900000 -179492 900000 -209984 900000 -203505 -160270 -130297 -140037 900000 -73898 900000 -114846 900000 -107857 900000 -32015 -31447 -3355 -43839 900000 -83527 -3940 -113627 74421 58022 -9591 153212 -34699 900000 -48817 77495 19936 37960 16477 9494 45315 30555 83326 22674 58547 10846 72498 20235 40401 47950 16297 51219 11739 31013 16845 51388 -1129 25022 16187 2332 24909 5220 30573 5711 22440 5499 15143 17909 7524 21815 724 12426 4018 20131 -447 6846 -3792 -6263 -4711 -3488 4705 -2471 4143 -2734 2650 1875 1612 3495 -1506 4400 -7965 3425 -6848 -3982 -5398 -2433 33 -2842 55 -3078 -1562 -803 968 -1748 -1927 -2587 -3215 891 -810 735 -1578 -1731 -615 -1275 93 -956 -489 -388 2532 -279 3080 2140 3996 447 547 930 -206 2218 -134 1965 -267 592 1195 136 -343 -194 1443 -898 817 -1469 -1320 -2079 -880 -6640 900000 -1769 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1.224047e-03 -6.000000e+00 1.862609e-02 270.02 -2.00 20.00 -2.00 321.38 0.00e+00 4.735 0.002 302.00 328.00 3 7.5651e-01 4.7290e-03 6.9528e-02 -6.0000e+00 1.0954e+00 2.4613e-01 7.4049e-03 5.3591e-02 -6.0000e+00 1.1952e+00 -3.0026e-01 8.7036e-03 2.9201e-02 -6.0000e+00 7.0760e-01 1.1935e-01 4.0391e-03 1.2810e-02 -6.0000e+00 2.9590e-01 8.6991e-04 -3.5540e-04 6.7399e-05 1.5340e-04 -6.0000e+00 2.1192e-02 -2.3179e-02 0.0000e+00 12 8 8 10 0 0 38.05 17.10 0.25 -0.02318 -0.02585 429 91 2 8 0 114.580 15.00 17.10 8.24 21.69 22.09 26.1 973.04 -299094 -218366 -244391 -244606 -265968 -264512 -248362 -198304 -195766 -236472 -220158 -209072 -110549 -160341 -119632 -108814 -75479 -80790 -77943 -60518 -45279 -57104 -70251 -41024 -72453 -61601 -62238 -85797 -56808 -69804 -31814 -46947 -5488 -30172 -20892 -23724 -23478 -12995 -11652 9646 -1217 7872 6152 11234 5842 9126 6826 6635 14845 7136 14321 6437 12208 7530 6738 10018 5824 8233 4863 7661 4128 7693 7596 9816 7653 4646 4898 1821 4309 3218 4747 2551 3323 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