File name: Pandora132s1_Berlin_20250627_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20250627T231725.8Z 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 v1.8.75 Instrument operation file used: Pandora132_OF_v1d20200910.txt Instrument calibration file used: Pandora132s1_CF_v13d20210422.txt Level 1 file used: Pandora132s1_Berlin_20250627_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: 20250627 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 20250627T035425.5Z 9309.162795 99 1 48.85 2 82.37 61.26 94.47 40.78 0.00 1 0.00 1 0 25 5.055e-01 3.748e-02 4.814e-01 3.018e-02 8.622661e-01 1.882639e-02 1.019384e-02 -6.000000e+00 3.111057e-01 233.70 -2.00 3.85 -2.00 322.04 0.00e+00 -1.639689e-02 9.721297e-03 5.506871e-03 -6.000000e+00 1.518679e-02 281.02 -2.00 20.00 -2.00 321.58 0.00e+00 6.990 0.008 302.00 328.00 3 2.4734e+00 7.0259e-02 9.6423e-02 -6.0000e+00 7.8709e-01 9.7246e-01 9.0977e-02 8.0226e-02 -6.0000e+00 8.5426e-01 -1.3129e+00 7.4901e-02 2.8896e-02 -6.0000e+00 5.0168e-01 5.2854e-01 3.5386e-02 1.4254e-02 -6.0000e+00 2.1216e-01 1.8381e-05 1.0562e-03 9.1744e-04 1.3616e-04 -6.0000e+00 1.4889e-02 1.3737e-02 0.0000e+00 12 9 8 11 4 0 82.01 11.94 0.73 0.01374 0.02167 22 5 4 8 0 2220.150 14.99 11.94 26.68 25.90 26.41 32.3 1028.42 2728 -82338 900000 -37797 900000 -141988 -95062 -31109 900000 -138472 -69756 900000 -5147 900000 30146 900000 138252 900000 -6553 86894 13370 24050 900000 -3101 900000 27696 900000 92864 136829 900000 9737 59128 55932 900000 -41400 900000 -61191 900000 49741 48185 900000 136880 900000 -15688 900000 -6738 130930 146589 46823 18609 40904 99738 -26977 153701 23709 64741 -21800 124038 43931 48154 57228 26367 163544 11152 36851 7230 7955 46042 40704 21371 26464 27131 -595 38253 1462 55584 -4366 13469 -17169 -3349 -3055 10271 5229 6156 13711 -5708 4757 1098 6459 1195 -2149 8426 -8891 7534 -16469 -2582 -3823 -7189 -6686 3105 -1128 -7036 8940 -7911 8293 -2209 1754 -5331 -3264 3373 -5860 258 -1673 -2112 -472 3514 29 588 1301 3365 2135 263 3482 -215 3144 -560 -149 2954 480 531 -828 2156 438 1618 -671 133 -100 1122 -1717 -758 -366 -1729 900000 80 -2817 900000 -1108 900000 -6246 -3020 -912 900000 -9136 -2387 900000 -151 900000 884 900000 4054 900000 -227 2548 392 705 900000 -124 900000 886 900000 2723 4012 900000 337 1734 1640 900000 -2649 900000 -5546 900000 2254 2569 900000 4014 900000 -1589 900000 -575 3839 4299 2497 1439 2835 4254 -4459 4958 2718 5178 -4184 5820 3865 3851 4272 2952 5755 1784 4617 1195 1336 5769 6185 4444 5573 5714 -157 6221 304 6683 -850 2370 -4806 -973 -1034 3450 2007 2495 5483 -2921 2270 544 2944 542 -945 3212 -4124 3294 -10669 -1707 -2966 -6497 -6327 2583 -890 -5271 5458 -5990 5726 -1791 1458 -5230 -3576 3957 -8358 364 -2413 -2967 -627 4440 40 833 1918 4872 3012 359 4465 -279 3806 -679 -183 3922 759 953 -1649 4461 989 3892 -1761 359 -274 3026 -4628 -1895 -840 -3780 900000 SS 20250627T040503.3Z 9309.170177 103 1 49.58 2 80.93 63.26 93.46 42.88 0.00 1 0.00 1 0 17 6.091e-01 1.651e-02 3.388e-01 9.960e-03 7.787435e-01 5.835680e-03 9.615819e-03 -6.000000e+00 3.609583e-01 233.70 -2.00 3.85 -2.00 321.88 0.00e+00 9.061813e-03 3.123134e-03 1.809771e-03 -6.000000e+00 1.564958e-02 281.02 -2.00 20.00 -2.00 321.41 0.00e+00 6.015 0.005 302.00 328.00 3 1.7466e+00 2.1658e-02 7.6904e-02 -6.0000e+00 9.1039e-01 4.0318e-01 3.0439e-02 5.0008e-02 -6.0000e+00 9.8139e-01 -5.4470e-01 3.0350e-02 2.8218e-02 -6.0000e+00 5.8075e-01 2.2088e-01 1.4027e-02 1.3563e-02 -6.0000e+00 2.4740e-01 1.0629e-04 -9.2013e-04 2.9252e-04 1.8347e-04 -6.0000e+00 1.6998e-02 1.2938e-02 0.0000e+00 12 9 8 11 4 0 65.39 11.96 0.40 0.01294 0.00602 85 18 4 8 0 583.150 15.00 11.96 27.18 25.90 26.41 32.0 1030.77 -206802 -228933 -185790 900000 74064 -222815 -152845 -133703 -207515 -199284 -175405 -166889 -112465 -153216 -100893 -83771 122836 -57126 -55871 -42849 55968 -80478 -52229 -95028 -67948 14817 -77949 -3101 25757 -13243 26480 1135 17774 -21291 43033 -3341 88773 -16954 10753 -6373 12212 12712 15218 29075 7912 4915 10447 20599 -4290 13746 24396 18105 35952 8823 21842 6779 27281 3514 23636 14813 14758 10009 -5165 16283 16366 13820 7267 8546 4057 8232 9122 3167 8579 3196 5533 -5750 -3950 -5825 3707 1938 1312 -1917 -4249 2559 -3183 -322 -950 1385 678 82 -403 -3319 2720 -2978 -460 -2120 -2287 -553 -1478 -1626 -1027 -83 696 -244 -3569 -1454 -1887 -1110 -52 109 -1215 -468 590 -679 394 -160 208 78 601 -325 1469 1570 1554 811 219 464 1192 1840 275 225 -239 -528 909 551 344 -754 58 129 -335 262 -186 -1451 900000 -3103 -4850 -2624 900000 719 -3737 -1484 -1298 -3663 -3342 -2477 -2652 -1390 -3787 -1870 -1553 1193 -1109 -1139 -790 543 -2110 -1065 -3137 -1781 173 -2271 -42 275 -244 411 28 414 -744 752 -94 1121 -741 428 -347 605 667 813 1383 476 315 659 1240 -354 1041 1871 1652 3002 1037 2354 875 2887 461 2456 1683 1791 1448 -1003 2846 2956 2523 1432 1784 1012 2035 2399 897 2211 801 1338 -1412 -932 -1516 1037 604 482 -823 -2022 1208 -1697 -177 -549 792 384 45 -205 -1649 1272 -1612 -283 -1564 -1974 -533 -1529 -1646 -944 -68 529 -194 -3144 -1326 -1842 -1173 -62 145 -1817 -726 902 -1014 557 -223 299 119 959 -529 2280 2320 2215 1128 296 603 1542 2601 455 422 -493 -1160 2099 1371 914 -2099 164 363 -931 683 -453 -3371 900000 SS 20250627T041936.6Z 9309.180285 108 1 49.48 2 78.93 65.98 92.01 45.71 0.00 1 0.00 1 0 17 4.645e-01 1.166e-02 2.231e-01 5.016e-03 6.663192e-01 2.849069e-03 8.221216e-03 -6.000000e+00 2.781273e-01 233.70 -2.00 3.85 -2.00 321.38 0.00e+00 2.761938e-03 1.374578e-03 6.708988e-04 -6.000000e+00 1.194726e-02 281.02 -2.00 20.00 -2.00 320.86 0.00e+00 5.022 0.003 302.00 328.00 3 1.9306e+00 9.7975e-03 6.4463e-02 -6.0000e+00 7.0156e-01 1.2111e-01 1.3516e-02 4.1765e-02 -6.0000e+00 7.5687e-01 -1.5950e-01 1.3645e-02 2.1817e-02 -6.0000e+00 4.4522e-01 6.2183e-02 6.4459e-03 7.6331e-03 -6.0000e+00 1.8829e-01 2.6307e-04 -6.8027e-04 1.4880e-04 8.8252e-05 -6.0000e+00 1.3024e-02 1.3391e-02 0.0000e+00 12 9 8 11 4 0 94.47 11.92 0.28 0.01339 0.00828 115 24 4 8 0 430.150 15.00 11.92 27.65 26.00 26.41 32.0 1032.26 -214709 -28519 -145179 -188099 900000 -150399 900000 -225363 -14144 -191703 -36112 -163939 -95455 -633 -83956 11872 -61359 4599 -48692 45662 -22189 -45179 -5287 -50498 28216 -38933 42939 -56555 31515 -50690 -6033 -4702 -3791 31673 -19237 -2236 -18474 18230 -6271 17853 -1654 6016 10148 -5882 14726 -2936 18299 213 11964 -2600 6669 12682 3493 13896 527 14078 4611 6366 1841 8979 2910 6479 7132 2784 7603 -335 6092 685 5352 27 1131 2635 1011 1762 -2000 4320 -3851 948 -2117 498 -2326 -1656 -1422 -595 291 -2494 1011 -1472 269 -41 -276 382 -1448 822 -1589 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