File name: Pandora132s1_Berlin_20221119_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T183741.1Z 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_20221119_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: 20221119 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 20221119T073913.5Z 8358.318906 221 1 49.23 2 83.21 134.92 49.33 188.71 0.00 1 0.00 1 0 17 5.304e-01 3.239e-02 3.582e-01 2.051e-02 8.609180e-01 1.193971e-02 1.015016e-02 -6.000000e+00 3.064620e-01 220.69 -2.00 3.85 -2.00 322.17 0.00e+00 6.323631e-03 5.939743e-03 1.363847e-03 -6.000000e+00 1.518662e-02 270.60 -2.00 20.00 -2.00 321.74 0.00e+00 7.730 0.010 302.00 328.00 3 1.0800e+00 4.1754e-02 9.0775e-02 -6.0000e+00 7.5706e-01 1.1121e+00 5.3651e-02 5.1379e-02 -6.0000e+00 8.3550e-01 -1.4732e+00 4.7873e-02 2.6851e-02 -6.0000e+00 4.8956e-01 5.9700e-01 2.3520e-02 1.1395e-02 -6.0000e+00 2.0639e-01 3.7684e-05 -3.9797e-04 5.9779e-04 1.6366e-04 -6.0000e+00 1.5556e-02 -3.1305e-02 0.0000e+00 12 8 8 10 0 0 77.32 15.25 0.51 -0.03131 -0.03430 59 13 4 8 0 834.250 14.98 15.25 3.47 19.96 20.35 24.8 959.44 900000 -51638 900000 79485 -121687 900000 -93160 900000 -134405 900000 -127616 106523 900000 32156 900000 -22454 900000 29784 900000 34184 900000 900000 -48852 220208 -14143 900000 -11890 900000 -26697 -1922 -36623 40415 190321 429 900000 21370 900000 4734 155654 73890 23988 97034 14504 179873 -7899 152840 24126 88115 56082 48771 85186 17414 90525 4965 121410 16499 86961 10298 29637 34038 -10374 68929 13410 65348 399 27134 10524 9863 16752 14560 43415 4634 43276 972 14504 -9309 -8164 10684 -14755 29419 -10465 11915 -2041 4277 -4937 1908 1565 -4900 8369 -4990 4729 -6844 5809 -3622 -1676 -1268 -7287 -280 -5175 1815 -6664 2533 -3815 341 -3930 -6911 3389 -6559 -232 -2938 1451 -1026 -968 103 -3061 261 -3144 2406 222 2675 200 3091 2015 1432 5116 -379 3331 417 3347 -419 933 1270 -438 211 -1722 999 -360 2056 -326 401 -383 -2524 -1769 900000 -2060 900000 1585 -6840 900000 -3378 900000 -7555 900000 -6479 2125 900000 641 900000 -977 900000 864 900000 930 900000 900000 -2569 4392 -539 900000 -410 900000 -968 -65 -1926 1290 3796 23 900000 810 900000 255 3105 2653 1531 3097 1070 3588 -709 3048 1588 3163 2908 2918 3908 1737 4694 644 5085 2007 5203 1274 2837 2987 -1448 4812 1872 6126 76 3897 1784 1771 3141 3165 7620 1220 7423 233 2690 -1950 -1612 1854 -3855 5985 -3415 3921 -770 1605 -2149 816 701 -2381 3505 -2280 2018 -3112 2317 -1719 -827 -743 -5351 -221 -4691 1537 -5691 1745 -2552 220 -2829 -5438 2563 -5982 -226 -3394 1815 -1416 -1362 140 -4151 334 -4252 3242 323 3866 287 4097 2594 1807 6049 -458 3847 539 4904 -738 1809 2645 -991 510 -4539 2675 -993 5561 -890 1030 -913 -5694 -3855 SS 20221119T074732.1Z 8358.324677 225 1 49.46 2 82.32 136.69 49.58 191.37 0.00 1 0.00 1 0 17 5.867e-01 1.737e-02 3.741e-01 9.103e-03 8.053019e-01 5.036327e-03 9.340829e-03 -6.000000e+00 3.269155e-01 220.69 -2.00 3.85 -2.00 322.08 0.00e+00 2.499615e-03 2.635360e-03 1.454753e-03 -6.000000e+00 1.419723e-02 270.60 -2.00 20.00 -2.00 321.66 0.00e+00 6.971 0.007 302.00 328.00 3 7.4191e-01 1.7817e-02 8.2790e-02 -6.0000e+00 8.0249e-01 4.4871e-01 2.6208e-02 4.8525e-02 -6.0000e+00 8.7874e-01 -6.6890e-01 2.8653e-02 2.7481e-02 -6.0000e+00 5.2245e-01 2.8213e-01 1.3381e-02 1.0277e-02 -6.0000e+00 2.2311e-01 1.3109e-04 -1.0116e-04 2.6197e-04 1.3885e-04 -6.0000e+00 1.6090e-02 -3.1971e-02 0.0000e+00 12 8 8 10 0 0 1.45 15.25 0.41 -0.03197 -0.03273 137 29 4 8 0 360.970 15.01 15.25 4.19 19.96 20.35 24.8 963.23 900000 -187854 -57 -219107 -87806 -22734 -232720 -90559 -220230 -42860 -248161 -125719 -136265 -4771 -35674 10420 131842 -89547 48349 -87826 -6135 -81068 -24137 106346 -51481 13625 -76374 162355 -71349 -22221 2933 33288 10772 -30313 27119 -11973 21679 5828 220369 14858 17449 7438 23758 30759 4456 50691 1483 49121 15665 32207 24934 40879 38851 12876 24973 17678 33873 8878 23774 7194 2714 3019 4909 14666 7708 12999 2471 9753 6736 10184 8804 7486 9604 5467 5226 -6736 -5653 -7567 -897 3116 -3231 3745 -1802 1906 -2501 461 689 3239 2312 -2358 1467 -3464 -1968 -1333 -162 -2459 -1397 -1318 -1284 -1160 -2899 -435 -2609 -927 -1963 -1356 -998 -2023 -114 -866 429 -375 738 -801 -913 -793 -816 196 -61 863 421 1649 975 2036 1121 686 1006 179 1716 -153 572 113 63 -17 -231 341 -406 906 61 181 -144 -829 -1645 900000 -2880 -1 -4420 -779 -202 -4882 -804 -4976 -380 -8210 -1420 -2199 -42 -345 92 1170 -2168 429 -2268 -76 -1897 -364 944 -1188 169 -2305 1441 -1963 -414 52 532 249 -1103 530 -340 481 181 1956 607 774 389 1097 1338 253 1845 91 1962 932 1772 1660 2612 2793 1303 2372 1883 3127 1032 2279 792 323 399 736 2265 1355 2157 458 1783 1435 2404 2088 1854 2489 1368 1178 -1536 -1219 -1760 -227 915 -1090 1354 -757 823 -1201 228 356 1665 1184 -1212 681 -1601 -889 -644 -90 -1647 -1087 -1177 -1248 -1125 -2653 -345 -1941 -686 -1572 -1144 -892 -1986 -124 -1088 598 -563 1110 -1193 -1303 -1100 -1152 288 -95 1358 649 2386 1367 2747 1480 879 1268 245 2683 -281 1153 245 146 -43 -616 943 -1152 2555 172 482 -356 -1929 -3775 SS 20221119T085420.8Z 8358.371074 250 1 13.55 2 76.37 151.52 53.52 211.69 0.00 1 0.00 1 0 17 3.761e-01 1.512e-02 2.627e-01 1.251e-02 5.352519e-01 6.394095e-03 6.778283e-03 -6.000000e+00 2.111440e-01 220.69 -2.00 3.85 -2.00 320.28 0.00e+00 1.119994e-03 2.162805e-03 1.130259e-03 -6.000000e+00 9.243497e-03 270.59 -2.00 20.00 -2.00 319.81 0.00e+00 4.145 0.002 302.00 328.00 3 4.0840e+00 1.8542e-02 5.0270e-02 -6.0000e+00 5.1845e-01 1.2052e-01 2.2937e-02 3.0088e-02 -6.0000e+00 5.6838e-01 -4.6831e-02 2.1726e-02 1.5881e-02 -6.0000e+00 3.3648e-01 1.0160e-02 1.1208e-02 5.0250e-03 -6.0000e+00 1.4418e-01 8.0457e-05 -4.1494e-04 3.6201e-04 5.9083e-05 -6.0000e+00 1.0488e-02 -2.6906e-02 0.0000e+00 12 9 9 12 1 1 67.28 15.41 0.19 -0.02691 -0.03002 3 3 1 8 0 3344.220 15.01 15.41 6.76 20.04 20.46 25.0 975.17 900000 900000 -158305 -79093 10415 -106236 900000 -82668 15914 -109564 96281 -24304 267151 -43473 -19743 7095 -5244 164070 -8377 71467 -4286 48092 -25213 37461 -16137 -11283 22792 -13052 -6745 1130 32206 45467 9276 -3633 -12881 8939 3651 17069 -18662 7405 -10506 1422 3518 2757 4903 3336 -6681 -1480 7186 2658 18527 3434 6401 4131 1881 1985 -385 3569 -5086 -3045 -3656 -4929 4030 2133 4525 1350 1362 -1685 3677 -2297 4572 1216 -578 3629 -246 692 -120 -1451 -4738 -1383 -38 353 -745 -3769 -193 825 -221 1114 1344 492 368 -394 -3580 637 -603 -40 -1600 -562 -187 -1140 -1361 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