File name: Pandora162s1_Brussels-Uccle_20240907_L2Fit_fout2c13d20231120p1-8.txt File generation date: 20240912T134816.9Z Data description: Level 2 spectral fitting results file Data file version: fout2c13p1-8 Local principal investigator: Michel Van Roozendael Network principal investigator: Alexander Cede Instrument type: Pandora Instrument number: 162 Spectrometer number: 1 Processing software version used: BlickP v1.8.59 Instrument operation file used: Pandora162_OF_v8d20191031.txt Instrument calibration file used: Pandora162s1_CF_v13d20231120.txt Level 1 file used: Pandora162s1_Brussels-Uccle_20240907_L1_smca1c13d20231120p1-8.txt Full location name: Uccle (BIRA-IASB, KMI-IRM) Short location name: Brussels-Uccle Country of location: Belgium Location latitude [deg]: 50.7980 Location longitude [deg]: 4.3580 Location altitude [m]: 107 Local noon date: 20240907 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: Based on session 12 for fieldcal First and last pixel inside fitting window: 225 367 Nominal wavelengths inside fitting window [nm]: 305.0129 305.1537 305.2944 305.4352 305.5759 305.7166 305.8573 305.9980 306.1387 306.2793 306.4200 306.5606 306.7012 306.8419 306.9825 307.1231 307.2637 307.4042 307.5448 307.6853 307.8259 307.9664 308.1069 308.2474 308.3879 308.5284 308.6689 308.8093 308.9498 309.0902 309.2306 309.3710 309.5114 309.6518 309.7922 309.9326 310.0729 310.2133 310.3536 310.4939 310.6342 310.7745 310.9148 311.0551 311.1953 311.3356 311.4758 311.6161 311.7563 311.8965 312.0367 312.1769 312.3170 312.4572 312.5973 312.7375 312.8776 313.0177 313.1578 313.2979 313.4380 313.5780 313.7181 313.8581 313.9982 314.1382 314.2782 314.4182 314.5582 314.6982 314.8381 314.9781 315.1180 315.2579 315.3978 315.5378 315.6776 315.8175 315.9574 316.0973 316.2371 316.3769 316.5168 316.6566 316.7964 316.9362 317.0759 317.2157 317.3555 317.4952 317.6349 317.7746 317.9144 318.0541 318.1937 318.3334 318.4731 318.6127 318.7524 318.8920 319.0316 319.1712 319.3108 319.4504 319.5899 319.7295 319.8690 320.0086 320.1481 320.2876 320.4271 320.5666 320.7061 320.8455 320.9850 321.1244 321.2638 321.4033 321.5427 321.6821 321.8214 321.9608 322.1002 322.2395 322.3788 322.5182 322.6575 322.7968 322.9361 323.0753 323.2146 323.3539 323.4931 323.6323 323.7715 323.9108 324.0499 324.1891 324.3283 324.4675 324.6066 324.7457 324.8849 --------------------------------------------------------------------------------------- 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 20240907T060543.5Z 9016.253975 76 1 49.93 2 81.48 91.16 123.00 70.49 0.00 1 0.00 1 0 17 5.615e-01 3.433e-02 4.686e-01 3.508e-02 6.975649e-01 2.056354e-02 8.635615e-03 -6.000000e+00 3.332623e-01 229.63 -2.00 3.79 -2.00 321.67 0.00e+00 1.067819e-02 1.022345e-02 2.349988e-03 -6.000000e+00 1.798379e-02 281.23 -2.00 20.00 -2.00 321.17 0.00e+00 6.358 0.005 302.00 328.00 3 3.4326e+00 7.3056e-02 7.4763e-02 -6.0000e+00 8.4015e-01 5.9132e-01 9.3136e-02 4.1579e-02 -6.0000e+00 9.1839e-01 -7.1228e-01 7.9163e-02 2.3601e-02 -6.0000e+00 5.3740e-01 2.8316e-01 3.7893e-02 1.3768e-02 -6.0000e+00 2.2747e-01 1.4854e-05 9.4828e-04 1.0743e-03 2.0249e-04 -6.0000e+00 1.5853e-02 7.1136e-05 0.0000e+00 12 8 8 10 0 0 -85.33 18.78 1.30 0.00007 0.00720 14 3 4 8 0 3565.440 14.99 18.78 21.26 21.06 21.38 1.3 959.03 900000 150397 -173395 -149187 -50623 900000 -131332 -180593 900000 -208916 900000 900000 -22607 900000 -3865 900000 125373 900000 900000 900000 78445 900000 -21648 95940 900000 61790 4691 900000 900000 -105076 -61375 900000 900000 192995 12484 22151 150772 92775 151467 157160 19747 16158 55156 -10483 30070 64026 116668 -11029 22591 -12969 -5207 63255 44162 37397 19988 34372 35322 10004 6253 33370 -7281 13263 1882 21527 15433 -7458 4813 11863 39159 1206 14697 -9413 -6037 16819 7171 6509 18003 -16297 15828 4145 -2833 2909 -2581 -2678 8688 -4099 -2485 5398 8303 -3098 -8470 4133 12268 -2594 3068 -5561 -7645 -3075 -178 -1080 -1253 3114 -1785 -3987 4278 -5188 -4837 -1207 -1774 -654 1000 -199 -2892 -1790 212 -2512 1802 753 -2995 1089 1532 3199 4198 953 753 -481 3864 4961 -1369 54 602 1400 38 -1266 1353 1164 823 725 -657 -1301 96 -1385 -1827 900000 5129 -7605 -5088 -1726 900000 -4479 -6651 900000 -10959 900000 900000 -771 900000 -132 900000 4275 900000 900000 900000 2675 900000 -738 3272 900000 2107 160 900000 900000 -7286 -3290 900000 900000 6582 482 755 5142 3164 5165 5359 1214 1096 2682 -996 1953 3052 3979 -1147 1771 -1507 -613 4255 3905 3782 2524 3871 3999 1439 900 3595 -1184 1912 344 3703 3050 -1832 1020 2381 6487 330 3929 -3360 -2077 4405 1890 1550 3506 -4398 3433 1195 -1032 1154 -1200 -1326 4086 -2330 -1466 3063 4614 -1883 -5099 2055 5379 -1323 1631 -3741 -6130 -2726 -172 -1089 -1214 2627 -1422 -3134 3303 -4693 -4591 -1184 -1910 -781 1321 -288 -4402 -2651 294 -3415 2335 1028 -4504 1657 2335 4653 5820 1322 1007 -631 4696 6033 -1970 88 1081 2697 77 -2789 3107 2847 2072 1859 -1719 -3343 231 -3160 -3988 SS 20240907T062149.7Z 9016.265159 84 1 45.86 2 78.95 94.31 120.70 74.02 0.00 1 0.00 1 0 25 3.859e-01 1.359e-02 3.111e-01 1.037e-02 5.965452e-01 5.671629e-03 7.452119e-03 -6.000000e+00 2.231375e-01 229.63 -2.00 3.79 -2.00 321.19 0.00e+00 4.778265e-03 2.581788e-03 1.652588e-03 -6.000000e+00 9.812673e-03 281.23 -2.00 20.00 -2.00 320.65 0.00e+00 5.028 0.003 302.00 328.00 3 3.3558e+00 1.8901e-02 6.0677e-02 -6.0000e+00 5.5857e-01 1.4302e-01 2.5080e-02 3.5628e-02 -6.0000e+00 6.0464e-01 -1.6657e-01 2.4517e-02 1.9753e-02 -6.0000e+00 3.5809e-01 6.5106e-02 1.1856e-02 7.4466e-03 -6.0000e+00 1.5297e-01 6.8089e-05 -8.5866e-04 3.0563e-04 9.4250e-05 -6.0000e+00 1.0412e-02 1.2204e-03 0.0000e+00 12 9 9 12 1 1 99.80 18.78 0.57 0.00122 -0.00523 22 5 4 8 0 1984.820 15.00 18.78 21.44 21.06 21.38 1.3 960.19 -158660 25062 -127555 900000 134425 -182540 -44844 -110421 900000 -196355 -103029 -62896 -45226 -15109 -40314 2196 -82637 -23910 -56721 14113 -48205 -38405 -24150 -2692 38074 -15158 58720 -63954 8617 -23249 26522 5850 55504 -5971 -28234 -12095 19205 34456 12311 26482 8642 15418 -9329 15462 14027 3132 -10265 -8273 17138 16103 6911 14544 14548 -7239 7223 3448 4881 1587 6515 8960 2858 33 1616 5646 560 2279 3971 3619 -2307 4129 1524 5096 2561 814 -208 -78 6659 -3306 2663 -2864 -729 2840 57 -561 -2052 -391 -2565 -943 -1630 1648 -1795 42 851 -492 -453 -1187 307 -153 118 -216 -706 -1417 154 86 -629 -3175 -2280 -372 -1007 -1146 818 1100 -308 1035 -759 -202 625 305 445 -322 -124 227 889 439 574 1402 302 2018 891 827 -245 115 317 -598 -551 124 -643 594 171 -10 -11 -400 -709 -2279 253 -1812 900000 1358 -3840 -453 -1330 900000 -6657 -1465 -647 -479 -153 -658 29 -2827 -511 -1815 242 -1572 -1139 -632 -61 625 -439 864 -3023 197 -745 606 195 1331 -288 -1666 -585 726 1294 693 1567 693 1261 -1022 1390 1300 329 -1260 -1019 1716 1698 870 1899 2089 -1387 1287 663 956 324 1247 1645 562 7 391 1486 167 668 1101 1015 -726 1396 598 2057 1073 334 -81 -27 1979 -1052 856 -1129 -329 1424 33 -346 -1357 -273 -1940 -731 -1289 1244 -1321 28 535 -310 -306 -924 271 -155 133 -251 -799 -1484 144 78 -607 -3375 -2507 -427 -1254 -1571 1222 1755 -508 1638 -1164 -292 881 446 689 -529 -207 371 1389 672 842 1973 412 2707 1311 1366 -449 224 645 -1286 -1253 298 -1604 1491 436 -24 -27 -910 -1549 SS 20240907T062858.1Z 9016.270117 87 1 50.37 2 77.82 95.71 119.67 75.54 0.00 1 0.00 1 0 17 2.210e-01 5.548e-03 1.203e-01 2.491e-03 5.570944e-01 1.334458e-03 6.884968e-03 -6.000000e+00 1.272450e-01 229.63 -2.00 3.79 -2.00 320.95 0.00e+00 1.617995e-03 5.754848e-04 7.463938e-04 -6.000000e+00 5.506363e-03 281.23 -2.00 20.00 -2.00 320.40 0.00e+00 4.600 0.002 302.00 328.00 3 1.7845e+00 4.3143e-03 5.5748e-02 -6.0000e+00 3.1781e-01 7.7622e-03 5.7145e-03 3.2948e-02 -6.0000e+00 3.4380e-01 -1.2780e-02 5.6723e-03 1.7273e-02 -6.0000e+00 2.0430e-01 -5.4704e-03 2.7738e-03 5.5630e-03 -6.0000e+00 8.7298e-02 5.3367e-04 -4.0453e-04 7.3304e-05 6.6217e-05 -6.0000e+00 5.8498e-03 1.0697e-03 0.0000e+00 10 0 0 10 0 0 98.99 18.77 0.29 0.00107 -0.00197 178 36 4 8 0 281.350 15.00 18.77 21.62 21.06 21.38 1.3 962.21 -26338 6136 -95891 -74105 -73456 -130737 -97159 -25909 -50423 -67825 -67292 -51439 -20085 -27722 -17680 -27619 -2498 4463 471 -3402 -11968 -4182 -9394 -6380 -8220 -11126 -20851 -5223 -11347 1047 -6751 -16388 -217 -7760 -1449 -13566 486 -7154 -1438 -3035 -1050 1548 160 -806 -1665 -32 -661 1040 153 222 1674 948 2652 2309 1847 217 2014 142 1742 -56 417 635 2313 3718 2642 1278 577 -243 904 1981 675 1054 576 1207 64 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