File name: Pandora162s1_Brussels-Uccle_20241010_L2Fit_fout2c13d20231120p1-8.txt File generation date: 20241010T233257.1Z 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 v1.8.60 Instrument operation file used: Pandora162_OF_v8d20191031.txt Instrument calibration file used: Pandora162s1_CF_v13d20231120.txt Level 1 file used: Pandora162s1_Brussels-Uccle_20241010_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: 20241010 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 20241010T082717.1Z 9049.352281 132 1 45.15 2 69.73 130.93 138.95 75.17 0.00 1 0.00 1 0 17 2.273e-01 1.419e-02 2.685e-01 1.548e-02 4.065437e-01 7.955877e-03 5.200979e-03 -6.000000e+00 1.287594e-01 225.13 -2.00 3.79 -2.00 319.76 0.00e+00 1.546843e-03 2.294695e-03 5.338278e-04 -6.000000e+00 5.603209e-03 277.09 -2.00 20.00 -2.00 319.19 0.00e+00 2.856 0.000 302.00 328.00 3 5.6957e+00 2.2539e-02 3.6169e-02 -6.0000e+00 3.1869e-01 2.9882e-02 2.6775e-02 2.2787e-02 -6.0000e+00 3.4603e-01 7.2507e-02 2.2387e-02 1.1845e-02 -6.0000e+00 2.0600e-01 -4.4050e-02 1.1758e-02 3.8480e-03 -6.0000e+00 8.9149e-02 6.1949e-05 -7.3059e-04 4.5931e-04 4.1773e-05 -6.0000e+00 6.0145e-03 -4.9725e-03 0.0000e+00 12 8 8 10 0 0 99.98 18.78 0.78 -0.00497 -0.01046 55 11 4 8 0 820.720 14.99 18.78 18.90 21.17 21.79 1.4 942.60 62597 900000 -73117 47983 77361 -54297 -32079 166434 35892 56772 -14250 63455 -46855 -34140 -2676 -12957 -10673 -16751 30806 46409 5872 13438 17813 22461 -28934 13665 -23022 -3025 -7937 11753 -14444 15211 12159 -12849 -11031 2453 -3665 -15397 2698 -9670 11190 -5909 6387 6421 1528 9110 -2769 6641 -1489 -78 3825 6405 -1041 -2278 -1060 6438 773 395 4469 2417 4446 -2914 1292 -1232 1986 -2886 -1206 174 -1760 5115 -1061 1632 340 1039 901 -1902 3130 -505 686 -1525 -550 -2265 -1864 -316 -1893 -1253 -19 1696 -907 -270 1299 300 -968 -300 -3804 1511 -3775 2484 1137 889 -277 61 -891 493 -856 -1368 330 -1254 -644 1025 554 898 -951 1228 -1457 -1135 1968 1069 -1025 1270 142 -384 -21 1266 247 -177 783 -1135 845 173 -395 24 -726 675 313 1004 -816 219 -1462 -267 94 389 348 945 900000 -2667 724 1168 -1444 -721 2513 546 857 -391 958 -2055 -1597 -112 -696 -622 -1103 1392 1917 368 791 1020 1316 -2953 991 -2441 -261 -680 830 -1408 1268 1171 -1714 -1424 265 -441 -2370 420 -2035 2193 -1468 1478 1537 386 2164 -742 1629 -396 -21 1044 1867 -353 -834 -406 2368 310 161 1720 934 1701 -1272 597 -643 1063 -1580 -609 84 -903 2754 -682 1089 234 691 565 -1116 1582 -249 343 -874 -359 -1690 -1523 -269 -1723 -1217 -19 1768 -983 -286 1281 276 -833 -244 -3336 1395 -4131 2865 1465 1179 -356 72 -973 516 -968 -1670 414 -1675 -905 1527 896 1524 -1643 1993 -2266 -1643 2686 1509 -1557 2011 235 -632 -33 1930 365 -251 1051 -1519 1174 265 -655 42 -1310 1244 610 2064 -1769 480 -3287 -588 198 783 675 SS 20241010T084216.2Z 9049.362687 141 1 49.39 2 67.99 134.45 136.75 78.51 0.00 1 0.00 1 0 25 2.681e-01 3.123e-02 2.947e-01 2.986e-02 3.687996e-01 1.509494e-02 4.852968e-03 -6.000000e+00 1.518437e-01 225.12 -2.00 3.79 -2.00 319.26 0.00e+00 5.138234e-03 3.770942e-03 3.599431e-04 -6.000000e+00 6.566160e-03 277.09 -2.00 20.00 -2.00 318.69 0.00e+00 2.645 0.000 302.00 328.00 3 6.8157e+00 4.1871e-02 3.3570e-02 -6.0000e+00 3.7581e-01 1.3817e-01 4.8497e-02 2.2148e-02 -6.0000e+00 4.0811e-01 -8.3386e-03 3.5946e-02 1.0817e-02 -6.0000e+00 2.4278e-01 -1.3134e-03 1.8892e-02 6.0118e-03 -6.0000e+00 1.0439e-01 2.4682e-05 -4.7486e-04 8.6902e-04 5.0719e-05 -6.0000e+00 7.0877e-03 -2.1320e-03 0.0000e+00 12 8 8 10 0 0 99.10 18.79 3.23 -0.00213 -0.00570 20 4 1 8 0 2468.620 15.00 18.79 19.22 21.17 21.79 1.4 945.55 -48181 -30223 31193 20589 -25916 -136594 -30307 141513 38166 47218 -72236 -23715 -37752 71294 -24537 12136 53401 -10936 73024 45295 1258 -10450 46712 -19678 35540 86733 66419 19489 -19319 23020 9464 33928 10213 37661 1450 30567 40949 34579 9127 1802 1676 1904 4659 -2851 16947 -12354 3888 164 -2540 -12485 10171 10939 6050 7259 -5356 -306 -87 11813 -2674 4407 -1946 1966 -3777 -4184 8707 3049 9194 -6954 3474 -2338 1907 1642 5657 -1896 1110 -4034 3532 1763 -8286 103 -8490 -971 -3110 759 -5326 40 1116 -1167 4173 1699 1823 -2585 -1898 -7266 -5023 -3593 -1439 4171 104 1131 -423 88 -138 2646 -392 -571 -919 -4905 2614 -365 5642 236 -205 138 -72 -2601 1090 -1480 -121 -1418 -2302 2150 -18 1813 685 3319 -419 1427 676 1491 -377 1689 -183 969 2429 -535 -456 -79 -1220 -510 -1737 71 -216 -2207 -1360 908 607 -1079 -15163 -1235 4122 1112 1375 -5717 -1203 -2514 2076 -2090 849 2756 -1107 3525 2983 131 -1205 3110 -2575 2870 4465 4239 1904 -2602 2063 1043 3332 1405 4299 228 3423 4351 4430 1773 444 466 562 1398 -950 4713 -4630 1249 55 -866 -4719 3243 3759 2343 2937 -2571 -142 -41 5014 -1285 1945 -927 965 -2157 -2635 5061 1811 4782 -4096 1906 -1523 1334 1221 4093 -1433 765 -2660 1953 931 -4935 64 -6508 -776 -2771 684 -5364 41 1202 -1338 4596 1886 1896 -2585 -1734 -6641 -4666 -3629 -1600 4927 140 1540 -559 107 -154 2795 -455 -712 -1201 -7008 3653 -565 8851 408 -353 225 -109 -3786 1488 -2127 -181 -2292 -3878 3445 -29 2743 997 4502 -560 1834 926 2203 -610 2805 -318 1714 4461 -1074 -940 -165 -2615 -1073 -3559 137 -400 SS 20241010T085154.8Z 9049.369384 146 1 50.75 2 66.92 136.78 135.32 80.57 0.00 1 0.00 1 0 17 2.463e-02 5.607e-03 9.479e-03 1.045e-03 3.670055e-01 5.307413e-04 4.748215e-03 -6.000000e+00 1.395000e-02 225.12 -2.00 3.79 -2.00 319.09 0.00e+00 4.424793e-04 1.250131e-04 1.804870e-04 -6.000000e+00 6.030720e-04 277.09 -2.00 20.00 -2.00 318.50 0.00e+00 2.532 0.000 302.00 328.00 3 2.6875e+00 1.4567e-03 3.2236e-02 -6.0000e+00 3.4527e-02 2.1882e-02 1.6791e-03 2.0390e-02 -6.0000e+00 3.7490e-02 7.2882e-03 1.2484e-03 1.0314e-02 -6.0000e+00 2.2302e-02 -1.0823e-02 6.6298e-04 3.0721e-03 -6.0000e+00 9.5927e-03 1.8587e-03 -2.1733e-04 3.0471e-05 3.2745e-05 -6.0000e+00 6.5093e-04 -4.0399e-03 0.0000e+00 10 0 0 10 0 0 99.96 18.79 0.29 -0.00404 -0.00567 268 54 1 8 0 186.550 15.00 18.79 19.49 21.17 21.79 1.4 946.70 -10316 2296 -10745 -6265 -8016 -10835 -7237 -8020 -3143 -5947 -1031 -9281 1684 -4345 -690 -1393 -988 -995 -602 -391 -1989 662 -1284 1605 -2277 294 -1389 -1406 -1438 -1940 459 -55 2660 -492 -2033 -3013 -1126 -1985 -657 -167 -1093 -1170 -1020 -493 -796 360 -1038 76 -779 -229 349 627 862 983 830 839 1629 379 670 176 705 1295 1426 2022 1344 -58 -84 63 216 1480 278 819 268 356 247 -366 12 -1089 -178 -264 -706 -694 -1551 -1980 -1113 -1026 -563 58 225 692 346 875 38 541 479 201 203 567 868 -320 -137 -704 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