File name: Pandora132s1_Berlin_20221027_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T183543.7Z 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_20221027_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: 20221027 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 20221027T064054.3Z 8335.278406 57 1 49.34 2 84.30 119.68 104.88 106.25 0.00 1 0.00 1 0 17 5.792e-01 5.885e-02 4.985e-01 5.165e-02 8.171274e-01 2.846728e-02 9.648582e-03 -6.000000e+00 3.368336e-01 222.97 -2.00 3.85 -2.00 321.82 0.00e+00 -1.074227e-02 1.269643e-02 6.939644e-03 -6.000000e+00 1.705570e-02 273.79 -2.00 20.00 -2.00 321.30 0.00e+00 8.908 0.016 302.00 328.00 3 1.2556e+00 9.5476e-02 1.0886e-01 -6.0000e+00 8.3433e-01 1.3565e+00 1.1249e-01 7.5468e-02 -6.0000e+00 9.1982e-01 -1.4493e+00 7.9035e-02 2.5144e-02 -6.0000e+00 5.3617e-01 5.3183e-01 4.0920e-02 1.0925e-02 -6.0000e+00 2.2266e-01 1.0173e-05 1.7460e-03 1.4438e-03 8.5776e-05 -6.0000e+00 1.6802e-02 -2.4267e-03 0.0000e+00 12 8 8 10 0 0 66.64 17.34 0.78 -0.00243 0.01069 18 4 4 8 0 2740.570 15.01 17.34 18.36 21.79 22.19 26.6 1000.18 900000 -70778 53636 -10845 900000 -51361 900000 -40404 900000 900000 -47841 37466 -83988 900000 -23111 -28302 -36236 900000 68248 79907 114264 -90393 900000 -4952 202611 900000 900000 -73105 131558 176853 149839 110991 -30183 900000 -27368 127212 36616 156105 152364 37656 900000 5087 124078 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3705 -1358 4278 -3692 3386 6306 2123 258 -8242 160 -11593 12813 -6558 1269 -9996 -5133 1906 -3403 11754 -5074 2009 -1392 3459 -12702 -4573 1958 -9691 -5294 -939 10181 -1553 -4697 -13365 4400 3838 4047 -4548 -1966 12838 -7813 487 -1814 6860 2749 -3905 9117 1160 6987 2825 6965 4326 5258 7185 -5629 966 -10010 1718 -3002 988 752 5821 -5192 4412 -4906 -4369 SS 20221027T064705.9Z 8335.282707 60 1 50.22 2 83.49 120.96 104.03 107.38 0.00 1 0.00 1 0 25 4.837e-01 3.622e-02 4.207e-01 2.850e-02 7.715487e-01 1.600704e-02 9.407795e-03 -6.000000e+00 2.814938e-01 222.97 -2.00 3.85 -2.00 321.90 0.00e+00 1.067134e-02 7.581797e-03 9.894197e-04 -6.000000e+00 1.308623e-02 273.79 -2.00 20.00 -2.00 321.41 0.00e+00 8.004 0.011 302.00 328.00 3 1.4058e+00 5.4707e-02 9.0949e-02 -6.0000e+00 6.9770e-01 1.0797e+00 6.7807e-02 4.9146e-02 -6.0000e+00 7.6715e-01 -1.2266e+00 5.7214e-02 2.3189e-02 -6.0000e+00 4.5130e-01 4.8211e-01 2.8483e-02 1.3715e-02 -6.0000e+00 1.8742e-01 2.1431e-05 -1.5427e-03 8.3261e-04 1.8568e-04 -6.0000e+00 1.3970e-02 -2.4245e-03 0.0000e+00 12 8 8 10 0 0 95.30 17.34 0.53 -0.00242 -0.01402 27 6 4 8 0 1859.560 15.00 17.34 18.67 21.79 22.19 26.4 1001.02 -63556 -67036 119974 900000 -64482 900000 -113817 900000 -53210 900000 3690 -74299 -18684 -53610 900000 59503 900000 -12612 900000 2404 8345 900000 -53944 96483 -68452 64443 72936 900000 -8057 94430 131743 45620 181180 -33291 900000 -45677 134392 -1939 204077 59657 -8036 116152 20184 102882 -30370 900000 -11346 39319 15719 40073 103875 -5681 152568 -3212 25415 -11534 8581 21070 13984 58447 -23800 39605 34667 75336 -97 35861 1541 13845 16696 9417 42534 1779 17485 -1111 11243 -8692 -1381 -2157 -15581 194 -14915 17344 -7584 9065 940 9917 5862 -5634 1158 -3834 13710 -11154 1727 -6296 -2603 -836 -2321 1928 -6360 780 -3103 210 -6518 3340 2317 -1745 1258 -4562 38 -5416 1956 -2947 660 -3475 -2073 -673 -555 1817 -907 6511 1173 4721 2960 510 579 -929 4939 -2628 2743 -1664 1848 -1711 2525 1118 -1207 1208 -732 1635 -1199 315 -1344 -622 -1574 -2644 -3381 3328 900000 -2276 900000 -5740 900000 -1476 900000 102 -2810 -518 -2704 900000 1650 900000 -668 900000 109 337 900000 -3673 2676 -5351 1788 2023 900000 -305 2619 3654 1772 5026 -2854 900000 -3916 3728 -132 5661 3144 -811 3866 1629 3995 -4059 900000 -1287 3054 1613 3446 5186 -845 5501 -526 3525 -2123 1277 2922 1978 5188 -4561 4943 5193 8359 -21 5968 326 2995 3936 2446 9320 538 4321 -302 2651 -2242 -318 -532 -4675 60 -6243 5948 -3614 3863 460 4676 3001 -3281 619 -2050 5739 -5653 762 -3254 -1503 -561 -1850 1682 -6479 730 -2770 161 -4964 2358 1771 -1470 1095 -4579 41 -7061 2633 -4399 953 -5065 -2849 -892 -754 2547 -1379 9358 1730 6404 3941 676 744 -1169 5829 -3651 4177 -3021 3560 -3647 5481 2637 -3105 3153 -1980 4346 -3223 791 -3182 -1367 -3446 SS 20221027T070022.2Z 8335.291923 63 1 49.56 2 81.79 123.73 102.23 109.81 0.00 1 0.00 1 0 17 5.559e-01 1.613e-02 3.340e-01 9.178e-03 6.709088e-01 4.995390e-03 8.058640e-03 -6.000000e+00 3.156316e-01 222.96 -2.00 3.85 -2.00 321.73 0.00e+00 4.756590e-03 2.529270e-03 1.846925e-03 -6.000000e+00 1.372026e-02 273.79 -2.00 20.00 -2.00 321.26 0.00e+00 6.569 0.006 302.00 328.00 3 1.4557e+00 1.7187e-02 7.5143e-02 -6.0000e+00 7.7888e-01 2.5197e-01 2.4094e-02 3.9638e-02 -6.0000e+00 8.5315e-01 -3.1687e-01 2.5599e-02 2.2389e-02 -6.0000e+00 5.0358e-01 1.2995e-01 1.2105e-02 8.9716e-03 -6.0000e+00 2.1034e-01 1.0605e-04 -5.6546e-04 2.7488e-04 1.2333e-04 -6.0000e+00 1.5462e-02 -3.0754e-03 0.0000e+00 12 8 8 10 0 0 67.90 17.35 0.21 -0.00308 -0.00732 78 17 4 8 0 635.190 15.00 17.35 19.05 21.79 22.19 26.5 1002.71 -186954 4855 -165075 -118376 -226646 900000 -219769 900000 -163750 -153444 -122548 -171356 45472 -122885 900000 -55442 65728 -59910 12241 -41823 -19145 85438 -55531 153655 -70152 107459 -7704 137859 -12880 -37511 5798 -19059 58244 -15268 166315 -4396 12517 14105 6023 24860 -6793 41436 -12250 10865 -5343 15258 1185 8599 30415 -7993 20535 12686 19373 -1646 18796 -1817 6208 3439 3820 18917 1267 16251 3322 13869 3685 4768 4814 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