File name: Pandora132s1_Berlin_20250601_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20250601T231112.0Z 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_20250601_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: 20250601 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 20250601T034935.3Z 9283.159436 99 1 48.41 2 83.31 62.06 110.02 359.61 0.00 1 0.00 1 0 45 6.574e-01 9.706e-02 4.921e-01 6.859e-02 9.740049e-01 4.278993e-02 1.222554e-02 -6.000000e+00 3.999661e-01 232.38 -2.00 3.85 -2.00 321.68 0.00e+00 -1.365792e-02 1.319318e-02 2.093583e-03 -6.000000e+00 1.828693e-02 278.20 -2.00 20.00 -2.00 321.05 0.00e+00 7.819 0.011 302.00 328.00 3 2.1570e+00 1.3290e-01 9.8991e-02 -6.0000e+00 1.0134e+00 2.0947e+00 1.5616e-01 6.9492e-02 -6.0000e+00 1.1037e+00 -2.0776e+00 9.6020e-02 2.7175e-02 -6.0000e+00 6.4245e-01 6.8286e-01 5.1086e-02 1.5559e-02 -6.0000e+00 2.6813e-01 6.8845e-06 -1.2846e-03 1.9332e-03 2.0540e-04 -6.0000e+00 1.9652e-02 4.0651e-02 0.0000e+00 12 8 8 10 0 0 92.24 14.87 1.11 0.04065 0.03100 13 3 4 8 0 3722.770 14.92 14.87 24.72 29.58 30.01 31.9 1023.30 66001 41927 45567 99596 -12492 -30890 900000 -14908 223577 130785 -41588 900000 -37283 900000 120077 262149 900000 900000 46904 900000 99271 -22965 900000 -22914 900000 37621 900000 8375 -102756 6684 900000 146674 2289 27108 -24030 900000 -44206 900000 141996 64140 190415 -106 900000 35496 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12007 -1144 12175 -23777 7312 8322 11709 -2401 8936 -8143 5571 -2073 5112 9021 -7295 11838 -2302 10035 6535 11658 -2219 -7521 12011 -1521 10087 -13446 12338 -2946 -1502 -6492 8303 1715 -18940 3521 -9551 4179 -10882 7784 935 6809 11569 4791 7489 -6690 16924 -2089 6443 -15809 11928 -2978 -6640 -2791 -18024 8267 -4559 25344 -12956 18779 4917 2785 -10127 403 11698 -27625 1224 -12183 8427 10964 18775 2824 2964 -5367 -11080 900000 SS 20250601T040238.3Z 9283.168498 102 1 21.52 2 81.54 64.53 110.03 2.78 0.00 1 0.00 1 0 25 4.796e-01 2.188e-02 4.419e-01 1.743e-02 8.521732e-01 1.028180e-02 1.016665e-02 -6.000000e+00 2.880796e-01 232.38 -2.00 3.85 -2.00 322.04 0.00e+00 -1.555322e-04 5.633504e-03 1.324345e-03 -6.000000e+00 1.296761e-02 278.20 -2.00 20.00 -2.00 321.60 0.00e+00 6.395 0.006 302.00 328.00 3 2.0110e+00 3.9118e-02 8.2798e-02 -6.0000e+00 7.2889e-01 5.1536e-01 5.5158e-02 5.4597e-02 -6.0000e+00 7.9093e-01 -8.2624e-01 5.4628e-02 2.9175e-02 -6.0000e+00 4.6260e-01 3.4959e-01 2.5140e-02 8.9732e-03 -6.0000e+00 1.9464e-01 5.6501e-05 -1.6598e-03 5.0608e-04 1.2527e-04 -6.0000e+00 1.3732e-02 4.0317e-02 0.0000e+00 12 9 9 12 1 1 58.16 15.00 0.42 0.04032 0.02784 24 12 4 8 0 860.370 14.96 15.00 24.67 29.58 30.01 32.0 1023.13 -145638 -122929 900000 900000 33385 900000 44287 900000 900000 -42705 -238755 93643 8387 -106645 900000 -129543 900000 -117565 56652 1691 -115195 -76886 21547 -54205 -24303 8501 -109464 69102 -94123 30329 26027 -50535 9335 -22098 197860 21540 -49327 55542 23758 23950 51620 24861 22815 26160 2495 35800 1195 98155 19696 123257 33882 34471 13710 1134 42561 8831 30968 205 36756 6273 33542 5024 3446 11372 12818 23393 9748 19961 419 15550 19662 12414 8734 -12260 10553 -10581 19296 -8434 5815 -2101 6174 1066 -1004 2351 -1924 5915 -7319 4581 1705 4324 -1852 -351 2552 -3292 -16 -2583 -1267 -1913 -1380 655 -455 -4400 614 -7113 -2316 196 -4220 998 147 -3323 -1059 296 -215 -1386 -254 998 1124 1717 1069 -1146 375 1415 882 2054 2263 1683 1578 2917 -1249 276 -78 -299 425 -141 665 -395 321 -27 -74 -844 69 -1137 900000 -2471 -2086 900000 900000 566 900000 751 900000 900000 -725 -8470 1589 142 -1974 900000 -4196 900000 -3990 961 29 -3909 -1779 366 -1288 -454 144 -4221 1172 -3049 515 442 -1972 222 -712 3357 439 -2343 1131 806 935 1664 1097 1045 1154 140 1458 71 2332 1103 2719 2070 2340 1256 127 3322 1004 2837 25 2931 671 2902 656 526 1775 2023 3294 1621 3285 88 3166 4094 2796 1940 -3063 2059 -2334 3143 -2003 1431 -612 1943 399 -416 1004 -914 2746 -4030 2254 841 1967 -843 -151 1098 -1681 -9 -1825 -1032 -1773 -1339 602 -383 -3441 437 -5727 -1904 166 -4010 993 169 -4516 -1555 449 -327 -2066 -360 1388 1621 2604 1706 -1870 579 2056 1248 2789 2967 2147 2057 4216 -2191 542 -168 -632 956 -343 1706 -1057 865 -74 -194 -2095 171 -2688 900000 SS 20250601T041048.2Z 9283.174169 106 1 49.58 2 80.41 66.06 109.98 4.76 0.00 1 0.00 1 0 25 5.755e-01 1.983e-02 3.212e-01 1.095e-02 7.965402e-01 6.387270e-03 9.675429e-03 -6.000000e+00 3.381705e-01 232.38 -2.00 3.85 -2.00 321.89 0.00e+00 4.386019e-03 3.309384e-03 1.244270e-03 -6.000000e+00 1.466119e-02 278.20 -2.00 20.00 -2.00 321.42 0.00e+00 5.720 0.004 302.00 328.00 3 2.1556e+00 2.3215e-02 7.5359e-02 -6.0000e+00 8.5087e-01 4.5479e-01 3.2003e-02 5.0973e-02 -6.0000e+00 9.1992e-01 -6.6145e-01 3.1701e-02 2.6300e-02 -6.0000e+00 5.4434e-01 2.7356e-01 1.4792e-02 8.5866e-03 -6.0000e+00 2.3075e-01 9.2460e-05 -2.1119e-03 3.1963e-04 1.1266e-04 -6.0000e+00 1.5900e-02 4.0084e-02 0.0000e+00 12 8 8 10 0 0 94.58 15.01 0.40 0.04008 0.02421 76 16 4 8 0 652.180 14.92 15.01 25.02 29.58 30.01 31.8 1024.82 -5727 -204533 -151075 -180358 -163107 -196118 -208135 -178187 -200478 -156628 -181050 900000 -168855 900000 -122514 56414 15581 -29366 -35864 -39202 -46033 -78991 83512 -24753 66480 -64581 -21667 -7507 -35553 -33257 -30265 38417 -17405 38112 -14026 25937 -27898 41676 24924 28347 39368 57916 25067 -7796 31150 7730 -3885 1226 44407 24891 24262 40428 23627 31606 22003 12819 -7123 31396 10521 25209 23090 6303 25056 6737 25596 8593 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