File name: Pandora162s1_Brussels-Uccle_20240724_L2Fit_fout2c13d20231120p1-8.txt File generation date: 20240912T132857.7Z 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_20240724_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: 20240724 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 20240724T054923.3Z 8971.242631 209 1 10.27 2 74.79 77.26 76.52 232.96 0.00 1 0.00 1 0 25 2.764e-01 1.095e-02 2.518e-01 8.245e-03 5.478322e-01 4.422546e-03 6.791135e-03 -6.000000e+00 1.624073e-01 233.38 -2.00 3.79 -2.00 320.33 0.00e+00 -6.539769e-04 1.590057e-03 6.192016e-04 -6.000000e+00 7.046487e-03 283.33 -2.00 20.00 -2.00 319.70 0.00e+00 3.737 0.001 302.00 328.00 3 3.7757e+00 1.3374e-02 4.9162e-02 -6.0000e+00 4.0896e-01 5.0374e-02 1.6724e-02 3.2240e-02 -6.0000e+00 4.4118e-01 -2.2820e-02 1.5276e-02 1.5954e-02 -6.0000e+00 2.6100e-01 1.9944e-03 7.7187e-03 4.5651e-03 -6.0000e+00 1.1107e-01 1.5494e-04 -3.7813e-04 2.3561e-04 4.8997e-05 -6.0000e+00 7.3775e-03 2.6249e-03 0.0000e+00 12 9 9 12 1 1 99.22 19.11 0.62 0.00262 -0.00022 5 6 4 8 0 1709.690 14.99 19.11 22.07 21.38 22.09 1.3 964.87 -111579 900000 62682 -50300 84234 -74570 900000 -60922 115800 -115248 25482 -92694 51654 -71946 -35896 3731 -26942 71592 -52277 18554 -9974 7590 -36893 6852 -26077 32015 -1891 5161 -8592 -6989 91408 -7476 16684 -1852 -2130 -7503 -10117 8230 -8646 -30 -5579 12573 -4503 7316 1270 -4493 -3837 -2050 2640 5020 1626 2737 7955 -3737 1788 1760 6025 -1559 269 3778 -642 6014 1680 4027 742 3614 -1596 854 -246 2737 183 -609 744 -2334 3457 -851 3292 -1855 1264 1115 -765 -1795 -1902 -1998 -974 18 -1137 2317 -1645 719 602 -731 -827 -333 831 -2009 1200 -583 1260 -1117 -8 -628 -337 87 182 -1557 -686 -523 -1494 216 -476 1700 -482 918 494 -352 587 -572 911 83 -85 -283 675 -238 -54 681 -523 1460 1105 255 278 602 -568 273 -750 -372 -377 101 395 -258 462 -469 -299 -1621 900000 504 -531 677 -879 900000 -774 931 -3216 205 -2325 415 -2168 -937 79 -864 970 -2538 484 -359 233 -1796 240 -1378 1042 -89 221 -399 -324 1838 -456 925 -136 -155 -551 -812 646 -975 -4 -854 1748 -776 1162 215 -816 -700 -373 472 913 331 613 1855 -1053 510 525 1791 -505 84 1120 -200 1882 606 1586 321 1502 -667 349 -108 1321 101 -359 439 -1374 1807 -421 1437 -820 570 575 -463 -1235 -1433 -1592 -814 16 -1065 2179 -1617 681 542 -623 -665 -262 686 -1892 1235 -681 1579 -1460 -11 -732 -362 91 201 -1850 -841 -671 -2044 315 -752 2778 -808 1485 765 -523 851 -860 1413 136 -142 -465 1072 -370 -81 986 -737 2011 1627 413 483 1098 -1079 534 -1548 -801 -832 225 886 -574 986 -967 -596 SS 20240724T055506.5Z 8971.246603 211 1 49.86 2 73.90 78.32 77.21 234.18 0.00 1 0.00 1 0 17 9.402e-02 5.570e-03 8.318e-02 2.337e-03 5.191516e-01 1.238532e-03 6.377341e-03 -6.000000e+00 5.488087e-02 233.38 -2.00 3.79 -2.00 320.43 0.00e+00 1.615770e-03 4.584861e-04 3.598398e-04 -6.000000e+00 2.363371e-03 283.33 -2.00 20.00 -2.00 319.81 0.00e+00 3.545 0.001 302.00 328.00 3 2.8298e+00 3.7781e-03 4.6468e-02 -6.0000e+00 1.3825e-01 3.8314e-02 4.7775e-03 3.0285e-02 -6.0000e+00 1.4908e-01 1.2685e-03 4.4483e-03 1.5366e-02 -6.0000e+00 8.8422e-02 -1.4107e-02 2.2406e-03 4.9329e-03 -6.0000e+00 3.7553e-02 4.9318e-04 -4.6358e-04 6.7126e-05 4.8590e-05 -6.0000e+00 2.4912e-03 2.1823e-03 0.0000e+00 10 0 0 10 0 0 68.91 19.11 0.46 0.00218 -0.00130 88 18 4 8 0 566.470 15.00 19.11 22.32 21.38 22.09 1.4 967.80 -10101 983 -21659 -23470 -36980 -42352 -10319 2701 -34196 -34437 -56169 -22810 -11663 -14088 -4154 -9188 -7025 -1953 -6246 -8311 7920 -9550 6871 -10642 8151 -5641 -8832 -8360 -6419 4323 -6340 -35 2040 -462 -7421 -5792 -9692 -5023 1848 -3333 421 -2800 117 -4960 288 -883 -590 -1011 1696 744 -1118 2540 640 2225 -441 1122 675 1366 -642 1049 1271 773 2424 2464 805 201 1566 -17 1095 1352 290 1259 670 99 -86 160 -1378 -775 -414 -563 -787 -645 -2031 -1557 -1385 -902 -286 209 819 843 560 1144 361 426 687 496 263 676 585 -166 -146 -812 -839 -365 -347 -1411 -717 -976 -771 -26 100 512 91 -56 268 41 471 316 207 287 -557 -248 39 250 104 831 -55 844 1071 -81 208 -178 -92 -566 -56 -125 -349 467 84 -94 -65 31 -248 -62 6 -180 -199 -362 -415 -78 20 -429 -479 -919 -312 -170 -239 -79 -221 -186 -54 -195 -282 240 -346 216 -432 299 -254 -425 -392 -282 190 -317 -2 126 -32 -549 -403 -747 -431 181 -419 58 -435 19 -857 48 -151 -102 -177 295 136 -225 547 154 570 -124 322 202 410 -193 303 371 243 838 953 338 83 608 -6 448 630 154 707 384 55 -45 75 -591 -317 -177 -277 -452 -422 -1491 -1209 -1140 -794 -265 201 791 797 499 936 277 318 544 445 269 785 754 -221 -186 -953 -894 -377 -382 -1681 -889 -1283 -1081 -40 153 829 149 -88 433 62 696 482 335 452 -906 -394 65 402 160 1219 -78 1170 1597 -136 349 -320 -172 -1107 -115 -276 -796 1080 198 -217 -144 64 -494 SS 20240724T060334.3Z 8971.252480 215 1 50.21 2 72.59 79.88 78.24 235.96 0.00 1 0.00 1 0 17 9.938e-02 5.158e-03 6.087e-02 2.365e-03 4.807080e-01 1.249108e-03 5.971574e-03 -6.000000e+00 5.801005e-02 233.38 -2.00 3.79 -2.00 320.21 0.00e+00 9.673040e-04 4.241715e-04 3.774609e-04 -6.000000e+00 2.498083e-03 283.33 -2.00 20.00 -2.00 319.57 0.00e+00 3.294 0.001 302.00 328.00 3 3.1171e+00 3.7216e-03 4.3128e-02 -6.0000e+00 1.4613e-01 2.9750e-02 4.5802e-03 2.7985e-02 -6.0000e+00 1.5758e-01 4.2084e-03 4.0501e-03 1.3933e-02 -6.0000e+00 9.3463e-02 -1.3563e-02 2.0666e-03 4.1012e-03 -6.0000e+00 3.9695e-02 4.9410e-04 -4.4308e-04 6.8549e-05 4.4274e-05 -6.0000e+00 2.6331e-03 2.0389e-03 0.0000e+00 10 0 0 10 0 0 99.99 19.11 0.45 0.00204 -0.00129 86 17 4 8 0 583.740 15.00 19.11 22.87 21.38 22.09 1.4 971.83 -5630 -59021 17742 -40685 -22059 -45064 -10401 -16708 -42508 -8784 -39004 4278 -27169 1787 -15407 -515 -11095 -6428 -2444 -781 -7449 -5062 3325 -1100 1390 -862 -6294 -10560 -2571 -3805 -302 -4346 -457 -520 -5322 -2502 -8283 909 -2645 -750 -2485 -1649 -176 -230 -701 327 1 -634 789 -2608 1033 2491 2028 1139 1100 1155 907 123 338 109 904 1661 1297 1784 1240 162 729 -418 388 1295 1027 522 532 -449 720 -253 137 -338 -411 206 -425 -349 -1160 -1485 -1146 -685 -396 -9 144 688 591 1229 266 -18 469 19 375 746 321 -341 -183 -750 -944 -100 -60 -1176 -1346 -780 -441 -157 105 320 128 203 -10 107 334 199 381 -39 -267 -239 297 483 195 930 -45 860 718 194 -209 -85 -228 -209 97 0 -385 339 192 -280 125 -178 -384 -45 -953 160 -597 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