File name: Pandora132s1_Berlin_20211031_L2Fit_fout2c13d20210422p1-8.txt File generation date: 20241123T161329.3Z 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_20211031_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: 20211031 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 20211031T065503.7Z 7974.288238 236 1 48.46 2 83.62 123.42 39.39 174.03 0.00 1 0.00 1 0 25 5.569e-01 4.971e-02 4.659e-01 4.693e-02 8.521083e-01 2.726705e-02 1.045020e-02 -6.000000e+00 3.248262e-01 222.51 -2.00 3.85 -2.00 321.93 0.00e+00 -1.367008e-02 1.202682e-02 5.384797e-03 -6.000000e+00 1.662550e-02 273.21 -2.00 20.00 -2.00 321.43 0.00e+00 8.136 0.012 302.00 328.00 3 1.8329e+00 9.0746e-02 1.0361e-01 -6.0000e+00 8.0455e-01 1.2852e+00 1.1234e-01 8.2790e-02 -6.0000e+00 8.8746e-01 -1.5212e+00 8.9246e-02 2.7854e-02 -6.0000e+00 5.2414e-01 5.9739e-01 4.5542e-02 1.4993e-02 -6.0000e+00 2.2089e-01 1.1622e-05 -3.7286e-03 1.3622e-03 1.5865e-04 -6.0000e+00 1.6444e-02 -6.3912e-03 0.0000e+00 12 8 8 10 0 0 88.31 16.38 0.65 -0.00639 -0.03441 16 3 4 8 0 3028.640 14.99 16.38 18.55 20.77 21.17 23.6 991.17 -20032 900000 900000 900000 -52850 900000 126480 900000 38698 82956 900000 -62162 -62040 -49883 900000 900000 900000 900000 340 106512 -27538 900000 20405 76749 60737 900000 -14209 -75430 30379 -63663 261436 -43305 900000 -34051 -19133 91466 29072 900000 -49322 135779 13683 900000 35652 224728 71867 75359 126708 27443 255841 -17949 900000 1992 -16265 67557 36098 27721 45855 145321 30993 65693 -2503 16046 -1064 38123 18056 11442 39907 -9315 60113 11831 24869 13762 5402 43316 -19892 -520 -22738 72833 -16585 -4823 -5369 -8086 1468 2753 8536 4464 5755 8646 3864 -10981 743 6363 -11914 14505 -15973 -1183 -6671 4553 -1015 -5250 2775 -4344 -386 -12976 -7222 -6030 5616 -5835 5384 200 -786 1191 -5662 8255 -3778 2722 -2462 6883 598 -2171 2237 -2336 6104 474 6843 -521 1888 411 167 3792 -770 2969 -4575 2002 -881 1383 -1298 -130 478 233 928 -3858 807 -990 900000 900000 900000 -2411 900000 5769 900000 1765 3784 900000 -4640 -5145 -4137 900000 900000 900000 900000 21 4859 -2055 900000 931 3501 2771 900000 -1061 -9071 1386 -6072 11925 -4310 900000 -3389 -1508 4172 1447 900000 -7772 6194 1475 900000 3105 10251 4262 4125 5780 2162 11670 -2456 900000 273 -2900 6163 4341 3793 5324 6629 3727 5693 -384 2415 -194 5739 3145 2088 6007 -2202 8775 2895 5775 3652 1501 8299 -5774 -121 -5657 7973 -4608 -1420 -1870 -3319 603 1187 3681 2110 2792 4123 1891 -5920 333 2559 -5731 5774 -9936 -746 -5173 3606 -922 -4963 2244 -3351 -262 -10116 -5690 -4976 4378 -5541 5157 232 -1040 1660 -8616 10715 -5311 3488 -3369 8990 876 -3332 3191 -3312 7644 612 8030 -635 2216 528 250 6290 -1485 5935 -10530 4640 -2250 3608 -3538 -351 1263 584 2132 -8607 1674 SS 20211031T070907.5Z 7974.298004 239 1 49.65 2 81.86 126.36 39.31 179.31 0.00 1 0.00 1 0 17 5.543e-01 1.237e-02 3.371e-01 9.275e-03 7.316739e-01 5.106327e-03 8.660107e-03 -6.000000e+00 3.120816e-01 222.51 -2.00 3.85 -2.00 321.86 0.00e+00 6.382621e-03 2.642717e-03 1.198859e-03 -6.000000e+00 1.399487e-02 273.21 -2.00 20.00 -2.00 321.39 0.00e+00 6.625 0.006 302.00 328.00 3 1.2067e+00 1.7827e-02 7.7637e-02 -6.0000e+00 7.6819e-01 2.6177e-01 2.5681e-02 4.4271e-02 -6.0000e+00 8.4139e-01 -3.3273e-01 2.8358e-02 2.4183e-02 -6.0000e+00 5.0021e-01 1.3767e-01 1.3328e-02 1.0771e-02 -6.0000e+00 2.1111e-01 1.2028e-04 -5.8975e-04 2.7207e-04 1.3749e-04 -6.0000e+00 1.5316e-02 -6.4371e-03 0.0000e+00 12 8 8 10 0 0 81.34 16.38 0.41 -0.00644 -0.01087 104 22 4 8 0 477.320 15.01 16.38 18.95 20.77 21.17 23.7 994.55 -160675 -158331 900000 -253059 900000 -213687 -213130 -161311 -186061 -136668 -140479 -139929 -133856 -28971 -143254 900000 -62442 -46020 -25570 -71066 -70667 -6157 -36583 -50228 -3378 -72772 -35729 -42198 -38885 1694 -75596 2614 -41706 12086 -6460 -18140 -20495 6340 15478 14993 29853 -8749 41683 -10796 22859 2737 10827 7805 4177 12046 6506 11340 10195 7580 11969 7071 -656 5470 9362 -1545 15284 5822 6384 12957 7459 6108 5667 7925 853 7384 1374 2364 3169 5738 -1353 2157 2904 -5803 5488 -2325 993 -226 -1242 -2987 -2249 -494 -1102 573 -39 2664 -898 -711 -1873 -658 -2996 -802 -92 118 442 -950 -169 -2708 454 -1146 -1052 -1790 -1848 19 -733 261 425 -273 -425 -437 -463 -298 272 -605 870 -206 914 1037 891 1507 593 661 155 1472 -684 86 268 -309 -17 -131 458 -23 224 441 -160 87 -458 -788 -446 -1453 -1431 900000 -4783 900000 -2459 -2627 -1458 -2141 -1236 -1270 -1518 -1815 -262 -3626 900000 -960 -666 -324 -1478 -1469 -67 -562 -954 -43 -1908 -646 -801 -738 25 -2939 57 -1621 284 -175 -558 -723 206 560 637 1214 -562 1696 -761 1178 178 675 529 313 915 588 1097 1097 905 1439 927 -94 727 1160 -212 1879 889 1120 2390 1517 1242 1163 1691 222 2056 440 697 988 1618 -369 515 664 -1542 1523 -839 370 -97 -585 -1522 -1213 -278 -653 340 -23 1456 -476 -356 -939 -352 -1891 -583 -77 112 451 -968 -157 -2296 349 -920 -905 -1642 -1803 20 -861 345 619 -421 -655 -648 -655 -411 382 -902 1349 -329 1406 1522 1264 2061 791 849 199 2023 -1104 156 531 -656 -39 -315 1168 -61 605 1200 -431 222 -1098 -1779 -995 SS 20211031T071719.8Z 7974.303701 243 1 49.39 2 80.87 128.10 39.36 182.40 0.00 1 0.00 1 0 25 5.317e-01 2.577e-02 4.149e-01 2.009e-02 6.670049e-01 1.099255e-02 8.145568e-03 -6.000000e+00 3.057801e-01 222.51 -2.00 3.85 -2.00 321.55 0.00e+00 9.540699e-03 5.144797e-03 7.972860e-04 -6.000000e+00 1.432972e-02 273.21 -2.00 20.00 -2.00 321.08 0.00e+00 5.984 0.005 302.00 328.00 3 2.8723e+00 3.6315e-02 7.0612e-02 -6.0000e+00 7.5898e-01 4.3545e-01 4.7137e-02 4.2067e-02 -6.0000e+00 8.3511e-01 -5.9164e-01 4.5576e-02 2.0308e-02 -6.0000e+00 4.8914e-01 2.6595e-01 2.2173e-02 1.1309e-02 -6.0000e+00 2.0403e-01 4.1309e-05 -8.9907e-04 6.0352e-04 1.3237e-04 -6.0000e+00 1.5095e-02 -5.5142e-03 0.0000e+00 12 8 8 10 0 0 99.93 16.40 0.17 -0.00551 -0.01227 53 11 4 8 0 931.830 15.01 16.40 19.74 20.77 21.17 23.7 997.79 -176767 900000 -117279 -74942 -87379 -68420 900000 -95464 900000 -169182 900000 -151372 900000 99835 121511 38783 -47833 900000 29155 40541 -80803 900000 86637 130353 271592 1492 91169 10949 49473 -56424 120117 -23341 29007 900000 -37141 92505 54661 187363 1739 61018 8948 7903 13950 18011 19618 21941 79295 -18980 87397 1286 17576 5852 6233 25186 1247 29418 6819 19432 6538 16820 11441 17359 19386 11366 11314 -5163 17154 -6382 9952 3489 282 7441 -2067 -703 -8838 8125 -10007 5070 4587 -1492 6807 -3867 -1543 -3583 787 -6482 1153 1353 3288 1730 464 6885 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